data_6ro6_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 6ro6 _Structure_validation_residue.Date_analyzed 2019-10-04 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 ' 73' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 109.405 -0.591 . . . . 50.12 109.405 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.0 149.5 46.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.029 -1.081 . . . . 34.83 111.823 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.31 -44.35 92.55 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 120.39 -0.524 . . . . 32.02 111.502 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -101.18 118.27 60.57 Favored Pre-proline 0 N--CA 1.438 -1.053 0 O-C-N 121.98 -0.45 . . . . 40.01 109.925 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -57.03 142.3 94.09 Favored 'Trans proline' 0 CA--C 1.512 -0.603 0 C-N-CA 120.396 0.731 . . . . 30.65 111.212 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -66.47 -36.22 82.21 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 118.627 -1.229 . . . . 120.92 111.8 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.31 -31.85 81.8 Favored Glycine 0 C--O 1.243 0.689 0 C-N-CA 119.46 -1.352 . . . . 36.2 112.985 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.2 tp -73.03 -38.01 66.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.34 -0.944 . . . . 34.82 111.802 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 t -51.89 -44.64 63.83 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.366 -0.834 . . . . 38.72 111.183 167.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -62.23 -44.53 96.35 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 121.254 -0.904 . . . . 57.39 110.143 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.7 tp -57.49 -50.36 73.31 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 110.059 -0.348 . . . . 37.32 110.059 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.61 -38.01 77.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 121.097 0.475 . . . . 66.36 110.143 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.33 -11.28 59.82 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 121.362 -0.836 . . . . 52.37 113.028 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.77 127.05 92.8 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 109.631 -0.507 . . . . 56.43 109.631 -176.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.92 -29.49 27.91 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 114.005 0.733 . . . . 71.04 114.005 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 m -84.85 -44.93 12.78 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.728 0.695 . . . . 71.59 110.745 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 72.4 mt -95.92 -31.25 13.2 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 113.181 0.808 . . . . 64.54 113.181 -174.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.63 84.75 Favored Glycine 0 CA--C 1.494 -1.277 0 C-N-CA 120.648 -0.787 . . . . 52.74 114.835 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -51.09 -29.59 28.81 Favored 'Trans proline' 0 C--O 1.238 0.502 0 CA-C-N 119.799 1.8 . . . . 83.29 114.824 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -75.93 -8.53 57.15 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 113.875 1.065 . . . . 99.65 113.875 -172.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.3 mm -105.17 101.34 12.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 106.268 -1.753 . . . . 63.07 106.268 -168.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 64.9 p -67.09 158.89 79.71 Favored Pre-proline 0 N--CA 1.446 -0.659 0 C-N-CA 120.299 -0.561 . . . . 47.11 110.399 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -55.07 -35.85 91.39 Favored 'Trans proline' 0 C--O 1.235 0.36 0 N-CA-C 113.644 0.594 . . . . 44.51 113.644 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -63.95 -41.98 97.43 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.307 -0.957 . . . . 39.72 110.172 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.453 -0.899 . . . . 33.54 111.063 175.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 54.5 t -55.96 -46.84 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-O 121.661 0.743 . . . . 36.66 110.387 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 65.4 mtm-85 -73.01 -34.24 66.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.978 -1.089 . . . . 45.07 111.4 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -62.3 -50.25 72.4 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 118.4 0.545 . . . . 33.27 111.641 173.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.56 -35.83 81.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 119.658 -0.817 . . . . 27.74 111.655 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 m -62.91 -19.77 64.53 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-N 117.918 0.326 . . . . 33.61 111.207 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -88.66 2.77 52.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 117.824 -1.084 . . . . 116.29 113.474 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 89.0 mt -88.69 114.66 27.37 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 119.396 0.998 . . . . 25.48 109.156 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.2 152.7 13.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.8 -1.185 . . . . 57.02 107.8 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 23.3 tp -126.72 110.97 13.72 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 105.391 -2.077 . . . . 29.85 105.391 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 94.8 mtm-85 50.81 44.25 28.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.408 0.623 . . . . 49.91 110.932 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.45 -9.04 51.54 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 115.75 1.06 . . . . 38.55 115.75 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -86.01 128.99 34.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.438 1.119 . . . . 95.06 109.184 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -118.83 163.78 24.26 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 120.567 -0.453 . . . . 48.66 111.646 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -51.39 146.65 24.28 Favored 'Trans proline' 0 C--O 1.25 1.081 0 CA-C-O 122.758 1.066 . . . . 33.35 110.547 166.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . 0.867 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 21.2 mtm180 -85.71 -65.16 1.04 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.649 1.722 . . . . 146.2 115.649 -169.73 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -111.22 168.55 9.43 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 123.446 0.698 . . . . 39.09 110.22 -166.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -54.98 -40.62 70.27 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.633 -0.712 . . . . 63.3 112.526 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLN . . . . . 0.419 ' OE1' ' OH ' ' D' ' 118' ' ' TYR . 7.8 tt0 -67.56 -34.42 77.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.408 -0.917 . . . . 65.67 111.894 -178.129 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.16 -42.06 96.89 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 121.192 0.52 . . . . 26.49 109.796 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -64.98 -42.03 94.9 Favored 'General case' 0 C--N 1.351 0.665 0 C-N-CA 119.085 -1.046 . . . . 24.7 110.652 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -65.1 -36.78 85.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 118.715 -1.194 . . . . 50.4 111.27 -178.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -58.41 -43.9 88.82 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 116.379 -0.373 . . . . 23.68 110.402 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.14 -45.24 87.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.244 0.545 . . . . 27.77 109.962 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -59.18 -46.16 89.15 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 119.768 -0.773 . . . . 40.8 111.122 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.3 -46.65 85.74 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.798 -1.161 . . . . 35.26 110.972 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -67.9 -46.31 71.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 121.482 -0.761 . . . . 24.45 110.756 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.34 -38.07 89.73 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.168 0.509 . . . . 41.48 111.929 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.6 -39.16 92.88 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 120.787 -1.196 . . . . 81.98 110.735 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.74 -38.55 89.44 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 121.534 -0.729 . . . . 42.52 110.598 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 93.8 mt -65.74 -48.19 83.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 C-N-CA 120.767 -0.373 . . . . 35.53 110.966 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 42.2 mt -80.12 14.45 1.87 Allowed 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 112.761 0.652 . . . . 56.52 112.761 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.451 0.643 . . . . 133.88 110.51 -174.413 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . 0.431 ' OE1' ' OE2' ' B' ' 105' ' ' GLU . 4.2 pt-20 . . . . . 0 C--O 1.235 0.295 0 N-CA-C 105.971 -1.863 . . . . 107.48 105.971 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.24 149.99 49.5 Favored Glycine 0 C--O 1.251 1.188 0 C-N-CA 120.017 -1.087 . . . . 53.01 112.036 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.16 -42.21 69.34 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.256 -0.577 . . . . 73.8 110.779 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 mt -100.92 132.31 22.24 Favored Pre-proline 0 C--N 1.351 0.648 0 C-N-CA 114.238 -2.985 . . . . 53.28 111.581 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.96 142.38 43.64 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 N-CA-C 109.875 -0.856 . . . . 30.66 109.875 167.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' LYS . . . . . 1.504 ' CG ' ' CD ' ' B' ' 78' ' ' LYS . 1.8 pttp -63.64 -37.78 88.63 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 119.26 -0.976 . . . . 109.98 111.588 -175.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.65 -31.29 79.52 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 119.01 -1.567 . . . . 25.25 112.278 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.4 tp -75.76 -38.69 58.12 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 117.182 0.491 . . . . 32.9 110.311 177.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 37.9 t -57.12 -42.23 80.48 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.919 -0.712 . . . . 42.95 111.579 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.22 -39.15 91.84 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 119.937 -0.705 . . . . 36.78 110.773 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 49.8 tp -66.95 -49.11 66.5 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.898 -0.501 . . . . 31.69 111.135 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.25 -35.91 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.144 0.497 . . . . 50.46 111.96 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.63 -13.2 59.94 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 112.407 0.521 . . . . 37.41 112.407 -176.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.54 122.12 84.62 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 109.12 -0.696 . . . . 73.51 109.12 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.56 -22.25 65.14 Favored 'Trans proline' 0 C--O 1.239 0.557 0 CA-C-N 119.157 0.735 . . . . 65.0 113.802 -173.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 84.4 m -89.6 -52.09 5.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 118.594 0.634 . . . . 95.61 111.768 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.9 mt -86.11 -28.64 23.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.26 0.837 . . . . 84.3 113.26 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . -58.06 -50.25 67.81 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 116.054 1.182 . . . . 52.61 116.054 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.92 -24.84 45.52 Favored 'Trans proline' 0 C--O 1.241 0.652 0 N-CA-C 114.79 1.035 . . . . 77.62 114.79 -163.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -76.73 -16.74 59.42 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.839 0.745 . . . . 138.74 112.68 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 89.2 mt -86.47 112.04 22.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.602 -0.888 . . . . 65.06 108.602 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 69.1 p -82.6 162.51 55.49 Favored Pre-proline 0 C--O 1.239 0.508 0 CA-C-N 116.265 -0.425 . . . . 41.38 111.032 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.18 -37.5 94.18 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 120.382 0.721 . . . . 37.13 113.819 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.41 -39.78 80.66 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 118.671 -1.212 . . . . 33.61 110.646 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -72.87 -37.17 67.43 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.189 -0.604 . . . . 27.56 111.933 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 74.0 t -57.44 -44.63 84.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 120.008 -0.677 . . . . 35.22 109.738 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ARG . . . . . . . . . . . . . 1.8 tpp85 -60.36 -49.06 79.11 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 121.783 -0.573 . . . . 139.2 110.676 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 54.3 m -56.43 -50.47 71.56 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-O 121.288 0.566 . . . . 26.0 111.763 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.65 -39.33 84.6 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 121.795 -0.566 . . . . 24.41 111.716 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 81.4 p -57.12 -24.32 53.33 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 112.669 0.618 . . . . 36.02 112.669 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -89.21 5.53 44.35 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 118.666 -0.683 . . . . 45.21 112.394 -175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 96.2 mt -89.56 116.18 30.54 Favored 'Isoleucine or valine' 0 C--O 1.243 0.736 0 CA-C-N 119.281 0.946 . . . . 25.78 110.264 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' B' ' 73' ' ' GLU . 15.1 tt0 -162.62 148.82 12.69 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 107.903 -1.147 . . . . 59.67 107.903 -173.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 15.9 tp -122.51 111.06 16.36 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 106.284 -1.747 . . . . 33.69 106.284 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ARG . . . . . . . . . . . . . 6.1 mtp85 46.57 47.12 14.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.148 0.975 . . . . 41.21 111.429 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLY . . . . . . . . . . . . . . . 83.62 -5.82 76.44 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 114.988 -1.006 . . . . 41.96 114.729 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -97.44 132.72 42.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 118.678 1.239 . . . . 123.13 109.385 -177.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -118.51 151.15 49.31 Favored Pre-proline 0 C--N 1.353 0.755 0 C-N-CA 123.741 0.816 . . . . 108.6 111.358 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.34 144.81 2.76 Favored 'Trans proline' 0 C--N 1.364 1.393 0 N-CA-C 109.881 -0.853 . . . . 26.33 109.881 168.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ARG . . . . . 1.155 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 7.8 mmm180 -93.03 -48.46 6.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 112.859 0.689 . . . . 127.43 112.859 -164.446 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -123.06 169.23 11.41 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.124 -1.03 . . . . 40.88 112.758 -168.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -57.79 -37.72 74.23 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 118.401 -1.32 . . . . 54.14 111.457 -173.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' GLN . . . . . 0.421 ' OE1' ' NZ ' ' C' ' 125' ' ' LYS . 13.8 tt0 -61.83 -40.09 94.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.455 -0.498 . . . . 105.4 112.312 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -63.31 -41.64 98.95 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.139 -0.689 . . . . 28.22 109.139 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -66.86 -40.72 87.95 Favored 'General case' 0 C--O 1.25 1.103 0 O-C-N 122.06 -0.4 . . . . 21.94 111.932 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -65.03 -38.72 91.81 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 119.027 -1.069 . . . . 42.37 110.761 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -55.56 -44.48 76.85 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.343 -0.389 . . . . 23.38 111.723 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 62.7 mt -67.9 -47.67 78.3 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 123.837 0.855 . . . . 24.91 110.881 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -56.72 -49.28 75.63 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.932 -0.576 . . . . 34.37 110.664 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.71 -44.32 90.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.024 -1.471 . . . . 30.15 111.834 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -68.67 -47.25 66.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 119.4 -0.92 . . . . 23.14 110.313 -178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.06 -38.57 89.28 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.606 -0.838 . . . . 41.02 112.508 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -61.46 -37.37 83.34 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 120.565 -1.335 . . . . 68.27 111.361 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 56.7 ttm-85 -63.51 -42.28 98.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.503 -0.879 . . . . 39.38 109.846 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ILE . . . . . . . . . . . . . 87.6 mt -69.08 -43.75 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 123.554 0.534 . . . . 34.15 110.89 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -93.37 -2.73 54.43 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.902 1.075 . . . . 44.91 113.902 -170.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--N 1.324 -0.503 0 N-CA-C 106.398 -1.704 . . . . 94.37 106.398 171.206 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.508 0 N-CA-C 113.531 0.172 . . . . 80.37 113.531 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' ALA . . . . . . . . . . . . . . . -106.58 1.4 25.26 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.806 1.039 . . . . 71.42 113.806 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.25 157.7 47.43 Favored Pre-proline 0 C--N 1.3 -1.566 0 CA-C-N 118.538 0.608 . . . . 45.23 109.907 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.17 143.46 41.92 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 N-CA-C 109.527 -0.99 . . . . 43.93 109.527 167.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -62.05 -38.25 88.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.483 -0.887 . . . . 131.91 112.204 -173.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.55 -30.42 76.42 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 118.968 -1.587 . . . . 39.83 112.44 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 15.7 tp -74.65 -43.21 56.45 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.409 -0.465 . . . . 35.69 111.357 177.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 5.3 m -56.18 -39.03 71.77 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.677 0.275 . . . . 59.47 110.595 171.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -62.57 -44.81 95.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.202 -0.599 . . . . 46.09 110.538 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.77 -43.05 99.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.208 -0.451 . . . . 39.53 110.617 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' ILE . . . . . . . . . . . . . 19.9 mm -68.16 -32.69 57.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 120.755 -0.378 . . . . 79.69 110.322 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.06 -11.47 59.99 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 118.844 -0.598 . . . . 49.69 112.287 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -65.7 124.84 88.51 Favored Pre-proline 0 C--O 1.24 0.585 0 C-N-CA 118.859 -1.136 . . . . 46.49 108.8 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.73 -18.24 28.78 Favored 'Trans proline' 0 C--O 1.237 0.464 0 CA-C-N 119.371 0.811 . . . . 58.0 113.893 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 24.0 p -97.38 -39.65 9.09 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.495 0.924 . . . . 69.76 113.495 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.07 -29.07 19.69 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 112.708 0.633 . . . . 59.97 112.708 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.97 -49.12 56.61 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 114.617 0.607 . . . . 48.45 114.617 -172.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -59.28 -27.6 85.44 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 114.035 0.744 . . . . 57.37 114.035 -167.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -73.74 -18.55 60.97 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.741 -0.784 . . . . 105.28 112.4 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' ILE . . . . . . . . . . . . . 46.6 mt -85.47 114.41 25.37 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 108.98 -0.748 . . . . 55.95 108.98 -171.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 42.8 p -78.72 163.52 60.48 Favored Pre-proline 0 C--N 1.309 -1.184 0 CA-C-O 121.071 0.462 . . . . 43.52 109.865 -173.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.85 -36.33 97.15 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 119.91 0.406 . . . . 41.75 113.036 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -59.23 -42.42 90.98 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 117.827 0.285 . . . . 43.53 110.548 176.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' TRP . . . . . . . . . . . . . 47.6 m95 -65.33 -39.36 92.31 Favored 'General case' 0 C--O 1.245 0.84 0 O-C-N 120.968 -1.082 . . . . 28.68 113.149 177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 69.3 t -57.59 -46.7 86.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.538 0.685 . . . . 35.84 109.362 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' ARG . . . . . 0.514 ' HD3' ' NH2' ' C' ' 103' ' ' ARG . 3.0 ttt180 -59.9 -48.74 80.47 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.997 -0.681 . . . . 112.81 111.442 178.128 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -50.8 69.96 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 121.479 -0.763 . . . . 23.33 109.939 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 78.7 mt -63.86 -40.5 96.69 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 121.847 -0.533 . . . . 23.67 110.091 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 59.8 p -61.04 -18.82 59.88 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.017 -0.673 . . . . 29.91 112.499 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ARG . . . . . 0.514 ' NH2' ' HD3' ' C' ' 99' ' ' ARG . 53.1 mtt85 -89.06 2.25 54.35 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 118.224 -0.893 . . . . 104.82 112.247 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 96.6 mt -89.14 111.39 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 118.953 0.797 . . . . 28.57 108.987 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -159.74 153.6 23.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.754 0.788 . . . . 58.24 109.839 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 11.8 tp -131.34 106.01 8.0 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 105.153 -2.166 . . . . 47.53 105.153 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' ARG . . . . . 0.837 ' NH2' ' O3 ' ' C' ' 201' ' ' SO4 . 88.1 mtm-85 47.2 39.97 9.35 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.471 0.653 . . . . 68.49 112.414 -174.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' GLY . . . . . . . . . . . . . . . 82.51 -9.85 57.32 Favored Glycine 0 C--O 1.24 0.504 0 N-CA-C 115.606 1.002 . . . . 49.13 115.606 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm -78.11 134.81 37.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.841 1.32 . . . . 116.81 108.649 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' ARG . . . . . 0.539 HH11 ' HG2' ' C' ' 110' ' ' ARG . 11.6 mtt-85 -137.41 161.96 57.75 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 107.463 -1.31 . . . . 125.15 107.463 -172.092 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -48.7 135.82 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 124.25 1.658 . . . . 35.47 107.903 166.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' ARG . . . . . . . . . . . . . 17.7 mtt180 -91.4 -34.51 14.83 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 118.337 -1.345 . . . . 155.0 113.431 -162.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 52.7 p30 -133.65 176.09 8.86 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-O 122.048 0.928 . . . . 43.18 109.742 -176.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . 23.2 pttt -63.95 -33.71 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.386 -0.825 . . . . 73.97 111.393 -174.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -64.92 -41.52 95.48 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.78 -0.768 . . . . 67.51 111.302 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.73 -43.47 97.84 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.383 -0.927 . . . . 41.07 109.845 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -65.33 -41.67 93.71 Favored 'General case' 0 C--O 1.247 0.942 0 C-N-CA 119.7 -0.8 . . . . 33.07 112.013 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.39 -39.67 92.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.689 -0.485 . . . . 52.73 109.689 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -59.49 -47.39 85.67 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.67 -0.412 . . . . 27.21 111.869 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 10.2 tp -70.93 -38.95 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 120.566 -0.454 . . . . 36.72 110.965 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -53.37 -49.23 67.63 Favored 'General case' 0 C--O 1.243 0.757 0 O-C-N 121.46 -0.775 . . . . 35.29 111.532 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 121.014 -1.053 . . . . 27.89 110.704 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -71.34 -44.09 65.74 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.696 -1.202 . . . . 22.29 110.412 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.11 -39.26 94.18 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.731 -0.605 . . . . 29.41 111.049 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' LYS . . . . . 0.421 ' NZ ' ' OE1' ' B' ' 115' ' ' GLN . 16.0 tttt -58.21 -34.74 70.73 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.345 0.593 . . . . 139.62 111.281 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -71.79 -28.75 63.82 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.519 -0.473 . . . . 36.05 111.185 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' ILE . . . . . . . . . . . . . 92.5 mt -81.84 -41.19 18.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 118.068 0.394 . . . . 29.21 111.269 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.08 -24.88 13.15 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.884 1.809 . . . . 50.96 115.884 -168.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' SER . . . . . . . . . . . . . 43.9 p . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 120.306 1.412 . . . . 150.31 108.269 -178.22 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.489 0 CA-C-O 120.205 -0.22 . . . . 88.01 113.384 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.59 149.18 31.1 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.508 -0.553 . . . . 80.86 109.508 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 tp -106.94 112.13 63.43 Favored Pre-proline 0 C--O 1.241 0.651 0 N-CA-C 109.16 -0.681 . . . . 53.31 109.16 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' PRO . . . . . 0.427 ' HB3' ' HD3' ' D' ' 110' ' ' ARG . 32.9 Cg_exo -67.39 148.27 79.16 Favored 'Trans proline' 0 C--N 1.331 -0.382 0 C-N-CA 120.875 1.05 . . . . 44.16 111.759 177.876 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' LYS . . . . . 0.438 ' HA ' ' HD2' ' D' ' 78' ' ' LYS . 1.1 tptt -69.12 -41.56 77.22 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 119.537 -0.865 . . . . 92.8 111.676 -171.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.35 93.16 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 119.719 -1.229 . . . . 39.16 114.327 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 33.5 tp -66.35 -45.03 81.58 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 121.912 -0.758 . . . . 38.53 110.656 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' SER . . . . . . . . . . . . . 36.5 t -53.76 -40.51 66.27 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.917 -0.313 . . . . 53.32 111.362 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -63.25 -42.84 99.22 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.631 -0.427 . . . . 47.72 111.454 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 23.7 tp -64.35 -45.61 87.05 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.97 -0.456 . . . . 37.27 111.412 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ILE . . . . . . . . . . . . . 40.6 mt -56.58 -39.68 64.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.682 -0.407 . . . . 52.54 111.093 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.74 -16.78 60.09 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.287 1.035 . . . . 56.45 113.61 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -57.42 121.28 46.81 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.256 -1.016 . . . . 46.78 108.256 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -68.15 -18.7 45.41 Favored 'Trans proline' 0 N--CA 1.475 0.432 0 CA-C-N 119.664 0.916 . . . . 66.81 114.327 -172.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' THR . . . . . . . . . . . . . 73.3 p -100.5 -41.77 6.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.093 0.861 . . . . 82.99 112.631 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' D' ' 92' ' ' GLN . 26.1 mt -88.07 -23.48 23.71 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.147 0.795 . . . . 55.35 113.147 -177.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLY . . . . . 0.421 ' N ' ' CD ' ' D' ' 91' ' ' PRO . . . -81.07 -34.36 26.94 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 116.556 1.382 . . . . 46.06 116.556 -167.328 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' D' ' 90' ' ' GLY . 50.9 Cg_exo -61.79 -28.04 81.29 Favored 'Trans proline' 0 C--N 1.327 -0.603 0 CA-C-N 118.951 1.375 . . . . 57.46 113.614 -173.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' D' ' 89' ' ' LEU . 4.3 pt20 -66.23 -22.1 66.32 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 118.722 -0.656 . . . . 81.28 112.361 -176.734 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' ILE . . . . . . . . . . . . . 2.8 mt -80.1 109.89 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.33 -0.989 . . . . 68.0 108.33 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 70.8 p -77.29 163.04 66.93 Favored Pre-proline 0 C--N 1.312 -1.041 0 N-CA-C 109.529 -0.545 . . . . 32.71 109.529 -175.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' PRO . . . . . 0.598 ' O ' ' HG3' ' D' ' 99' ' ' ARG . 61.8 Cg_exo -54.08 -38.81 87.34 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 N-CA-C 113.598 0.576 . . . . 30.46 113.598 172.532 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -57.91 -42.09 84.04 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 120.8 -1.188 . . . . 38.8 111.122 174.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' TRP . . . . . 0.412 ' CZ2' ' HA ' ' D' ' 125' ' ' LYS . 59.3 m95 -68.49 -35.65 77.82 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 121.269 -0.894 . . . . 29.84 112.416 178.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.72 -51.58 42.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 C-N-CA 119.43 -0.908 . . . . 33.48 109.934 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' D' ' 95' ' ' PRO . 41.4 mtp180 -61.27 -45.0 96.29 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.988 -0.685 . . . . 62.5 111.884 -177.82 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' THR . . . . . . . . . . . . . 45.2 m -62.13 -50.79 70.49 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.303 0.573 . . . . 26.3 110.838 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' LEU . . . . . . . . . . . . . 91.8 mt -66.82 -36.1 81.58 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.392 -0.818 . . . . 27.9 110.995 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' SER . . . . . . . . . . . . . 39.2 p -65.38 -14.81 61.69 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.257 -0.902 . . . . 28.71 112.343 -176.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -88.2 -1.27 57.92 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.179 0.807 . . . . 64.31 113.179 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' ILE . . . . . . . . . . . . . 78.3 mt -83.97 112.75 21.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 N-CA-C 108.99 -0.744 . . . . 33.2 108.99 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.74 151.52 18.52 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.674 -0.861 . . . . 56.1 108.674 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' LEU . . . . . . . . . . . . . 27.1 tp -122.71 113.6 19.43 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 105.916 -1.883 . . . . 34.11 105.916 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 52.04 39.05 25.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.369 0.604 . . . . 42.64 110.267 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' GLY . . . . . . . . . . . . . . . 85.64 -3.07 87.66 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-O 118.735 -1.036 . . . . 42.13 114.756 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . 3.4 mmmm -107.98 146.74 32.05 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.605 1.162 . . . . 106.45 109.692 -176.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ARG . . . . . 0.427 ' HD3' ' HB3' ' D' ' 77' ' ' PRO . 29.3 mtt-85 -127.12 164.38 35.81 Favored Pre-proline 0 C--O 1.244 0.782 0 CA-C-N 115.671 -0.695 . . . . 123.1 112.773 -169.289 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -44.83 137.96 8.79 Favored 'Trans proline' 0 CA--C 1.514 -0.511 0 N-CA-C 107.937 -1.601 . . . . 34.58 107.937 167.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' ARG . . . . . . . . . . . . . 55.4 mmt-85 -84.55 -37.64 20.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.453 -0.899 . . . . 115.41 112.201 -158.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 13.0 p30 -142.66 178.04 7.9 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.68 -0.637 . . . . 44.91 109.646 -170.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -53.95 -42.56 69.02 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.662 -0.699 . . . . 132.43 111.531 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -65.5 -41.46 93.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 116.477 -0.329 . . . . 57.18 110.574 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.63 -42.14 99.43 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.897 0.856 . . . . 35.69 110.646 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -67.26 -41.28 85.81 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.005 -1.059 . . . . 30.52 111.381 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' TYR . . . . . 0.419 ' OH ' ' OE1' ' A' ' 115' ' ' GLN . 9.9 t80 -62.55 -42.22 99.4 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.444 -0.503 . . . . 54.0 110.924 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.84 -45.32 90.33 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 116.471 -0.331 . . . . 23.3 111.673 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.15 -49.98 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 C-N-CA 124.553 1.141 . . . . 48.91 111.34 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -53.2 -47.36 68.98 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.65 -0.25 . . . . 37.24 111.526 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 93.2 mt -61.57 -43.98 97.86 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.862 -0.735 . . . . 31.84 111.017 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -69.25 -44.77 71.26 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 119.821 -0.752 . . . . 23.91 110.956 -178.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.83 -34.82 79.03 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 119.363 -0.935 . . . . 31.36 111.614 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' LYS . . . . . 0.412 ' HA ' ' CZ2' ' D' ' 97' ' ' TRP . 12.3 tttt -63.3 -34.71 78.28 Favored 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 121.432 -0.793 . . . . 115.63 109.922 -179.901 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -67.96 -34.94 77.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.118 -1.033 . . . . 32.79 111.188 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' ILE . . . . . . . . . . . . . 98.3 mt -74.8 -44.18 45.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 119.865 -0.734 . . . . 33.14 110.778 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.64 -125.14 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 106.477 -1.675 . . . . 55.4 106.477 -174.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.316 -0.89 0 C-N-CA 116.635 -2.026 . . . . 230.92 111.835 178.65 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.243 0 N-CA-C 112.195 -0.362 . . . . 90.12 112.195 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.52 154.01 19.94 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.801 0.81 . . . . 65.75 111.03 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 76' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.48 139.15 97.16 Favored Pre-proline 0 C--N 1.322 -0.612 0 C-N-CA 119.292 -0.963 . . . . 51.31 109.333 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 77' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.33 139.63 86.88 Favored 'Trans proline' 0 C--O 1.241 0.643 0 N-CA-C 110.4 -0.654 . . . . 35.08 110.4 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tptm -50.42 -50.55 51.63 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.897 0.703 . . . . 57.32 112.897 177.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.35 -32.06 82.85 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 119.548 -1.311 . . . . 27.67 111.792 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 80' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.59 -34.33 62.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 122.021 -0.693 . . . . 30.85 111.186 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 81' ' ' SER . . . . . 0.469 ' OG ' ' HG2' ' D' ' 99' ' ' ARG . 45.2 m -63.83 -33.31 75.39 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 120.154 -0.619 . . . . 37.82 111.41 171.295 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 82' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.16 -42.24 98.21 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.872 -0.731 . . . . 35.78 109.783 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 tp -65.87 -45.08 83.42 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.979 0.418 . . . . 51.84 110.155 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 84' ' ' ILE . . . . . . . . . . . . . 84.7 mt -58.27 -40.15 76.61 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.213 0 O-C-N 121.59 -0.694 . . . . 33.99 111.262 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.81 -3.48 56.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.923 1.082 . . . . 35.41 113.923 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 86' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.59 124.81 91.32 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 119.177 0.899 . . . . 47.26 109.316 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 87' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.33 -25.87 56.47 Favored 'Trans proline' 0 N--CA 1.475 0.423 0 CA-C-N 119.847 0.981 . . . . 66.38 114.229 -172.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 88' ' ' THR . . . . . . . . . . . . . 51.7 p -94.75 -41.82 9.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 119.257 0.935 . . . . 99.62 113.293 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 89' ' ' LEU . . . . . . . . . . . . . 44.2 mt -86.75 -32.13 20.57 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 114.462 1.282 . . . . 67.54 114.462 -177.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.08 -42.09 86.73 Favored Glycine 0 N--CA 1.439 -1.157 0 N-CA-C 116.21 1.244 . . . . 48.17 116.21 -174.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -55.97 -25.04 51.47 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.032 0.916 . . . . 96.03 114.051 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 92' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.59 -18.69 58.5 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.049 0.759 . . . . 157.18 113.049 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 93' ' ' ILE . . . . . . . . . . . . . 3.3 mm -95.88 88.16 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.816 -1.55 . . . . 80.49 106.816 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 94' ' ' THR . . . . . . . . . . . . . 71.4 p -60.77 161.05 16.29 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.793 -0.64 . . . . 46.19 110.206 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 95' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo -53.16 -34.67 69.98 Favored 'Trans proline' 0 N--CA 1.478 0.6 0 N-CA-C 114.248 0.826 . . . . 45.67 114.248 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 96' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -64.46 -40.92 96.62 Favored 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 119.252 -0.979 . . . . 44.84 111.72 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 97' ' ' TRP . . . . . . . . . . . . . 35.6 m95 -69.18 -33.02 72.72 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 119.681 -0.808 . . . . 36.5 110.596 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 98' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.97 -44.9 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 C-N-CA 119.342 -0.943 . . . . 48.49 110.27 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 99' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -63.88 -44.9 91.67 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.457 -0.897 . . . . 101.14 111.396 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 100' ' ' THR . . . . . . . . . . . . . 19.2 m -62.78 -44.38 96.33 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 119.331 -0.948 . . . . 33.19 110.698 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.53 -40.38 89.11 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.406 -0.361 . . . . 26.67 110.595 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 102' ' ' SER . . . . . . . . . . . . . 51.9 p -66.85 -15.26 63.5 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 120.082 -0.647 . . . . 36.25 112.092 -171.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -86.35 1.41 51.2 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 113.499 0.926 . . . . 165.62 113.499 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 104' ' ' ILE . . . . . . . . . . . . . 85.1 mt -89.88 109.84 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.048 -0.723 . . . . 37.9 109.048 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 105' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' E' ' 301' ' ' HOH . 1.1 pp20? -157.1 152.49 26.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.585 -0.894 . . . . 87.3 108.585 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 tp -132.27 104.66 6.87 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.81 -0.811 . . . . 54.75 108.81 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 107' ' ' ARG . . . . . . . . . . . . . 15.9 mmm-85 43.36 44.6 4.85 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.638 0.607 . . . . 106.41 112.638 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 108' ' ' GLY . . . . . . . . . . . . . . . 97.11 -22.45 40.68 Favored Glycine 0 N--CA 1.442 -0.956 0 CA-C-O 119.303 -0.721 . . . . 55.85 114.789 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 109' ' ' LYS . . . . . . . . . . . . . 17.3 mttp -78.43 148.99 33.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 118.145 0.973 . . . . 60.55 111.095 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 110' ' ' ARG . . . . . . . . . . . . . 32.4 ptt85 -161.56 166.26 15.08 Favored Pre-proline 0 C--O 1.244 0.793 0 N-CA-C 107.923 -1.14 . . . . 74.26 107.923 -171.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 111' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.56 153.91 74.76 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 N-CA-C 109.426 -1.029 . . . . 26.63 109.426 167.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -119.45 -40.23 2.81 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 114.358 1.244 . . . . 67.55 114.358 -169.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -121.08 173.86 7.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 119.469 1.031 . . . . 43.14 111.836 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 114' ' ' LYS . . . . . . . . . . . . . 52.7 pttt -64.45 -29.93 70.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 117.686 -1.606 . . . . 48.42 111.007 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 115' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -65.27 -43.35 91.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.001 -0.68 . . . . 102.87 111.376 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 116' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -53.67 -48.89 69.04 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 121.502 0.668 . . . . 32.63 110.401 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 117' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -66.72 -41.12 88.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.898 -0.592 . . . . 34.25 111.121 -175.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 118' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -71.25 -35.4 71.41 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.146 -0.622 . . . . 67.99 111.075 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 119' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -59.01 -45.86 89.61 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 120.912 0.387 . . . . 26.91 110.454 175.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 120' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.33 -50.01 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 122.1 -0.375 . . . . 30.41 111.024 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 121' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -48.23 -49.3 33.66 Favored 'General case' 0 C--N 1.349 0.547 0 N-CA-C 112.687 0.625 . . . . 51.66 112.687 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 122' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.57 -39.95 95.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 119.02 -1.072 . . . . 36.88 111.08 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 123' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -72.77 -41.68 64.78 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.589 0.709 . . . . 29.19 109.798 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 124' ' ' LEU . . . . . . . . . . . . . 16.2 mt -69.68 -41.33 75.6 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.953 -0.699 . . . . 64.55 111.64 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 125' ' ' LYS . . . . . . . . . . . . . 22.6 tttm -55.61 -34.68 65.09 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.412 -0.915 . . . . 132.87 110.562 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttm-85 -67.21 -29.03 68.58 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.516 -0.474 . . . . 59.08 110.303 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 127' ' ' ILE . . . . . . . . . . . . . 75.8 mt -92.0 -39.75 11.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 112.032 0.382 . . . . 61.81 112.032 -172.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 128' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 C--O 1.234 0.269 0 O-C-N 121.514 -0.741 . . . . 78.11 111.107 -179.254 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 76' ' ' LEU . . . . . . . . . . . . . 16.1 mt . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.018 -0.039 . . . . 57.25 110.916 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 77' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -60.08 142.37 98.24 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 O-C-N 122.166 0.561 . . . . 50.14 110.751 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 78' ' ' LYS . . . . . 0.498 ' HD3' ' OD2' ' F' ' 82' ' ' ASP . 1.0 OUTLIER -55.03 -44.75 74.93 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.593 -0.443 . . . . 63.82 112.033 -177.298 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' F' F ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.26 -25.52 72.39 Favored Glycine 0 C--O 1.248 0.99 0 C-N-CA 118.902 -1.618 . . . . 31.74 112.332 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 80' ' ' LEU . . . . . 0.445 HD22 HD11 ' F' ' 84' ' ' ILE . 3.3 tt -75.8 -47.53 25.39 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 112.445 0.535 . . . . 49.98 112.445 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 81' ' ' SER . . . . . 0.834 ' OG ' ' O ' ' F' ' 301' ' ' HOH . 25.8 t -66.57 -22.77 66.14 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 116.154 -2.219 . . . . 63.78 110.892 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 82' ' ' ASP . . . . . 0.498 ' OD2' ' HD3' ' F' ' 78' ' ' LYS . 96.6 m-20 -64.19 -42.29 96.73 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.218 -0.993 . . . . 39.95 110.7 171.974 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 83' ' ' LEU . . . . . . . . . . . . . 41.5 tp -60.26 -45.7 92.36 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 120.02 -0.672 . . . . 37.27 111.274 174.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 84' ' ' ILE . . . . . 0.445 HD11 HD22 ' F' ' 80' ' ' LEU . 60.5 mt -58.77 -32.4 46.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 122.082 -0.386 . . . . 107.81 111.583 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.68 -4.34 59.14 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.065 1.135 . . . . 40.14 114.065 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 86' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.14 125.24 88.15 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 108.896 -0.779 . . . . 43.59 108.896 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.99 -28.2 35.63 Favored 'Trans proline' 0 C--O 1.238 0.521 0 CA-C-N 119.238 0.764 . . . . 67.23 112.62 -176.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 88' ' ' THR . . . . . . . . . . . . . 54.5 m -81.38 -53.24 6.48 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.195 -0.315 . . . . 77.59 111.358 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 89' ' ' LEU . . . . . . . . . . . . . 20.8 mt -90.17 -22.87 21.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.705 1.002 . . . . 71.29 113.705 -173.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 90' ' ' GLY . . . . . 0.403 ' N ' ' CD ' ' F' ' 91' ' ' PRO . . . -64.6 -45.66 92.33 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 115.263 0.865 . . . . 47.5 115.263 -173.495 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 91' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' F' ' 90' ' ' GLY . 31.6 Cg_exo -62.1 -21.07 71.8 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 117.942 0.871 . . . . 61.77 113.1 -173.332 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 92' ' ' GLN . . . . . 0.945 HE22 ' HH ' ' F' ' 118' ' ' TYR . 1.3 tt0 -68.05 -20.6 64.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 112.558 0.577 . . . . 164.89 112.558 179.397 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 93' ' ' ILE . . . . . . . . . . . . . 21.6 mt -100.22 105.93 18.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.147 -0.686 . . . . 61.73 109.147 -163.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 94' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 162.65 72.88 Favored Pre-proline 0 C--O 1.242 0.678 0 CA-C-N 115.595 -0.729 . . . . 54.95 110.54 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.38 -37.93 62.02 Favored 'Trans proline' 0 C--O 1.24 0.583 0 O-C-N 122.082 0.517 . . . . 78.66 113.338 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 96' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -63.45 -39.95 95.83 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.316 -0.554 . . . . 54.64 110.771 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 97' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -67.0 -39.43 87.13 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 120.689 -0.404 . . . . 37.85 111.696 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 98' ' ' VAL . . . . . . . . . . . . . 97.6 t -54.65 -48.91 71.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 119.886 -0.726 . . . . 49.34 110.57 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 99' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -62.16 -44.96 95.47 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.884 -0.726 . . . . 105.11 111.104 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 100' ' ' THR . . . . . . . . . . . . . 18.0 m -59.48 -46.61 88.32 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 121.773 -0.58 . . . . 36.24 111.041 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' LEU . . . . . . . . . . . . . 72.6 mt -68.65 -37.98 80.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.25 -0.58 . . . . 28.1 111.42 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 102' ' ' SER . . . . . . . . . . . . . 67.6 p -62.72 -20.72 65.19 Favored 'General case' 0 C--N 1.348 0.526 0 CA-C-N 118.517 0.599 . . . . 46.63 111.695 -175.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 103' ' ' ARG . . . . . 0.588 ' O ' ' HD2' ' F' ' 103' ' ' ARG . 8.8 tmm_? -83.69 1.01 44.61 Favored 'General case' 0 C--O 1.247 0.94 0 N-CA-C 114.743 1.386 . . . . 137.98 114.743 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 104' ' ' ILE . . . . . . . . . . . . . 84.0 mt -85.58 106.34 15.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 107.552 -1.277 . . . . 33.22 107.552 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 105' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.22 146.13 10.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.89 -1.522 . . . . 107.81 106.89 -170.107 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tp -138.96 92.76 2.63 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.586 -1.264 . . . . 77.73 107.586 -175.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 107' ' ' ARG . . . . . . . . . . . . . 19.2 mtp85 45.51 46.41 10.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.654 0.74 . . . . 122.02 111.049 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.39 -15.39 63.36 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 115.095 0.798 . . . . 57.97 115.095 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 109' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -81.17 142.44 33.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 118.021 0.911 . . . . 100.07 109.873 172.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 ptt-85 -154.35 163.82 22.88 Favored Pre-proline 0 C--O 1.248 0.989 0 N-CA-C 108.905 -0.776 . . . . 95.47 108.905 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 111' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.11 151.78 48.69 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 121.517 1.478 . . . . 31.68 108.289 165.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 112' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -119.26 -15.51 9.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 115.487 1.662 . . . . 81.1 115.487 -161.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -151.74 176.64 11.2 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 119.297 0.953 . . . . 48.01 108.53 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -61.16 -38.7 87.38 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.189 -0.914 . . . . 65.42 110.988 -173.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 115' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -65.66 -38.78 90.27 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 119.539 -0.864 . . . . 98.97 110.629 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 116' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -58.6 -46.61 86.64 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.551 0.691 . . . . 34.39 110.867 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 117' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -66.99 -38.77 86.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 121.87 -0.519 . . . . 28.77 111.253 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 118' ' ' TYR . . . . . 0.945 ' HH ' HE22 ' F' ' 92' ' ' GLN . 13.0 t80 -67.73 -38.82 84.06 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 118.713 -1.195 . . . . 62.71 111.543 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 119' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -55.9 -48.17 76.12 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.93 0.395 . . . . 30.43 110.281 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 120' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.31 -49.5 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.119 0 CA-C-O 121.399 0.619 . . . . 31.4 110.213 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 121' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -50.22 -50.85 48.36 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 121.645 -0.659 . . . . 42.78 111.628 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 122' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.01 -41.81 98.47 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.949 -0.7 . . . . 35.73 110.887 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 123' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -69.34 -48.12 62.36 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 119.248 -0.981 . . . . 25.47 110.323 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 mt -61.3 -39.06 89.05 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.485 -0.486 . . . . 36.67 110.939 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -60.97 -36.33 79.13 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.473 0.654 . . . . 82.86 111.108 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 126' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -71.66 -37.07 70.84 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 122.053 -0.404 . . . . 47.97 111.108 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 127' ' ' ILE . . . . . . . . . . . . . 73.7 mt -71.69 -37.46 62.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-O 120.875 0.369 . . . . 55.46 110.25 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 128' ' ' LEU . . . . . . . . . . . . . 31.3 mt . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 109.633 -0.506 . . . . 52.41 109.633 -178.96 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 119.468 -0.301 . . . . 64.02 111.436 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 76' ' ' LEU . . . . . . . . . . . . . 12.3 mt -74.8 147.48 84.18 Favored Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 120.361 -0.535 . . . . 63.72 110.899 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -51.15 141.67 37.82 Favored 'Trans proline' 0 C--O 1.237 0.455 0 N-CA-C 109.777 -0.894 . . . . 51.26 109.777 167.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -55.72 -40.54 72.6 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.809 -0.632 . . . . 106.76 111.897 -174.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.94 -31.05 79.64 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.551 -1.309 . . . . 37.35 113.039 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 80' ' ' LEU . . . . . . . . . . . . . 41.5 mt -77.2 -36.36 54.95 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 118.627 -1.229 . . . . 49.06 110.894 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 81' ' ' SER . . . . . . . . . . . . . 11.8 t -60.34 -39.11 85.93 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 119.057 -1.057 . . . . 59.19 109.724 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 82' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -66.1 -40.44 90.77 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.436 -0.906 . . . . 43.63 111.474 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 83' ' ' LEU . . . . . . . . . . . . . 18.0 tp -60.18 -43.72 95.65 Favored 'General case' 0 C--N 1.347 0.481 0 CA-C-O 120.932 0.396 . . . . 38.51 110.857 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 84' ' ' ILE . . . . . . . . . . . . . 31.8 pt -73.54 -15.1 16.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.774 0 C-N-CA 119.245 -0.982 . . . . 41.63 112.119 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.57 -2.8 44.21 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.841 0.682 . . . . 34.97 112.841 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 86' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -82.77 129.35 62.42 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.256 -0.646 . . . . 40.1 109.256 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 87' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.22 -23.31 45.44 Favored 'Trans proline' 0 CA--C 1.498 -1.32 0 CA-C-O 118.293 -0.795 . . . . 45.76 113.799 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 88' ' ' THR . . . . . . . . . . . . . 36.9 m -87.83 -46.39 9.47 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 119.442 1.019 . . . . 36.93 111.578 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 89' ' ' LEU . . . . . . . . . . . . . 66.3 mt -88.16 -34.78 17.72 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 113.628 0.973 . . . . 40.05 113.628 -174.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.1 -47.7 32.76 Favored Glycine 0 N--CA 1.44 -1.042 0 C-N-CA 125.149 1.357 . . . . 29.16 115.593 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 91' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -71.91 -9.08 24.17 Favored 'Trans proline' 0 C--O 1.245 0.861 0 CA-C-N 119.06 1.43 . . . . 31.45 114.369 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 92' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -97.85 -2.84 39.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 112.958 0.725 . . . . 80.94 112.958 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 93' ' ' ILE . . . . . . . . . . . . . 19.5 tt -123.83 146.09 29.84 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.551 -0.907 . . . . 35.62 108.551 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 94' ' ' THR . . . . . . . . . . . . . 42.5 p -94.0 160.11 32.98 Favored Pre-proline 0 C--N 1.307 -1.244 0 CA-C-N 115.654 -0.703 . . . . 42.87 111.225 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.34 -38.04 92.35 Favored 'Trans proline' 0 C--O 1.241 0.668 0 N-CA-C 114.435 0.898 . . . . 40.72 114.435 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 96' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.92 -40.68 89.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.155 0.502 . . . . 89.88 111.297 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 97' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -64.97 -39.73 93.92 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.469 -0.77 . . . . 31.3 110.978 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 98' ' ' VAL . . . . . . . . . . . . . 90.5 t -56.91 -48.53 81.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 C-N-CA 120.157 -0.617 . . . . 36.86 111.141 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 99' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -57.45 -47.27 82.25 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.371 -0.831 . . . . 184.36 111.575 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 100' ' ' THR . . . . . . . . . . . . . 26.0 m -56.81 -48.11 78.7 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.648 0.737 . . . . 35.18 111.395 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.2 -36.19 83.4 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 121.639 -0.663 . . . . 33.48 110.638 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 102' ' ' SER . . . . . . . . . . . . . 32.7 p -61.52 -17.09 53.22 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.196 -0.602 . . . . 36.66 111.595 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 103' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -88.29 4.05 47.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.931 1.086 . . . . 110.64 113.931 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 104' ' ' ILE . . . . . . . . . . . . . 94.8 mt -90.67 118.07 35.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 119.867 1.212 . . . . 35.6 109.476 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -160.88 153.17 20.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.737 0.415 . . . . 100.31 110.046 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 106' ' ' LEU . . . . . . . . . . . . . 6.7 tp -137.63 101.53 4.5 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 106.295 -1.743 . . . . 63.66 106.295 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 107' ' ' ARG . . . . . 1.5 ' CB ' ' CG ' ' G' ' 107' ' ' ARG 0.278 19.2 mmt180 61.31 31.95 19.28 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.238 -0.914 . . . . 74.15 112.451 175.077 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' G' G ' 108' ' ' GLY . . . . . . . . . . . . . . . 93.16 -18.24 56.62 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 118.45 -1.833 . . . . 59.49 114.896 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 109' ' ' LYS . . . . . . . . . . . . . 7.7 mtmt -83.83 134.15 34.72 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 119.126 1.463 . . . . 103.23 110.497 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 110' ' ' ARG . . . . . 0.835 ' NH2' ' O ' ' G' ' 302' ' ' HOH . 6.8 mtm-85 -139.29 155.75 72.15 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 106.449 -1.685 . . . . 188.17 106.449 -175.304 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 111' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.07 148.05 25.13 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 N-CA-C 109.219 -1.108 . . . . 38.24 109.219 166.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 112' ' ' ARG . . . . . 0.417 HH12 ' HB2' ' G' ' 110' ' ' ARG . 45.4 mmt-85 -101.19 -65.03 1.0 Allowed 'General case' 0 C--O 1.234 0.242 0 C-N-CA 118.416 -1.314 . . . . 196.01 113.598 -172.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -97.69 169.59 9.58 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 123.08 1.419 . . . . 66.91 112.464 -172.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -60.72 -38.17 84.19 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-N 114.458 -1.247 . . . . 53.68 111.097 -171.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 115' ' ' GLN . . . . . 0.818 ' OE1' ' OH ' ' H' ' 118' ' ' TYR . 25.5 mp0 -67.29 -32.92 74.24 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-O 121.038 0.447 . . . . 63.16 111.608 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 116' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.34 -43.16 91.75 Favored 'General case' 0 C--O 1.245 0.834 0 CA-C-O 120.861 0.362 . . . . 43.19 111.146 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 117' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -62.37 -39.23 92.49 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.351 -0.539 . . . . 35.06 110.987 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 118' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.79 -38.53 80.05 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.096 -0.642 . . . . 41.82 110.925 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 119' ' ' GLU . . . . . . . . . . . . . 53.3 tt0 -57.27 -48.44 78.88 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.7 0.762 . . . . 27.9 109.829 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 120' ' ' ILE . . . . . . . . . . . . . 50.8 mt -63.17 -45.65 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.659 -0.651 . . . . 75.06 111.145 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 121' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -53.58 -50.76 64.9 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.184 0.439 . . . . 34.34 112.184 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 122' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.05 -42.66 90.8 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.565 -0.454 . . . . 27.36 110.624 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 123' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -68.08 -46.55 70.7 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.285 -0.885 . . . . 24.06 111.566 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 124' ' ' LEU . . . . . . . . . . . . . 20.5 mt -63.88 -36.14 82.97 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.853 -0.529 . . . . 32.84 111.641 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 125' ' ' LYS . . . . . 1.032 ' NZ ' ' O ' ' G' ' 301' ' ' HOH . 1.6 pttp -63.08 -29.09 70.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 119.714 -0.794 . . . . 103.98 111.72 -178.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 126' ' ' ARG . . . . . . . . . . . . . 39.7 ttm-85 -72.24 -16.46 61.93 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 113.509 0.929 . . . . 51.55 113.509 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 127' ' ' ILE . . . . . . . . . . . . . 96.6 mt -105.09 -49.77 9.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 112.736 0.643 . . . . 30.75 112.736 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 128' ' ' LEU . . . . . . . . . . . . . 9.7 mp -63.37 134.6 56.01 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.981 -1.075 . . . . 43.87 112.217 -171.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 129' ' ' SER . . . . . . . . . . . . . 59.9 p . . . . . 0 C--O 1.258 1.536 0 N-CA-C 113.014 0.746 . . . . 44.8 113.014 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 120.97 0.414 . . . . 68.06 111.162 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 76' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 149.2 97.28 Favored Pre-proline 0 C--N 1.327 -0.386 0 C-N-CA 118.948 -1.101 . . . . 64.6 109.635 167.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 77' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -54.43 142.64 69.41 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 109.034 -1.179 . . . . 43.02 109.034 170.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 78' ' ' LYS . . . . . 0.41 ' H ' ' CE ' ' H' ' 78' ' ' LYS . 0.8 OUTLIER -65.91 -35.04 79.53 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.456 -0.498 . . . . 111.32 111.616 -169.731 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' H' H ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.74 -32.21 82.26 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.071 -1.537 . . . . 36.56 112.955 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 80' ' ' LEU . . . . . . . . . . . . . 34.1 tp -75.75 -38.97 57.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.557 -0.967 . . . . 35.31 109.675 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -57.79 -41.62 82.48 Favored 'General case' 0 C--O 1.251 1.147 0 C-N-CA 119.48 -0.888 . . . . 42.63 110.741 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 82' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -62.29 -44.71 95.89 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 120.232 -1.543 . . . . 43.9 111.103 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.25 -45.4 83.99 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.934 0.397 . . . . 38.01 111.523 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 84' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.46 -24.16 21.7 Favored 'Isoleucine or valine' 0 C--O 1.243 0.735 0 C-N-CA 119.648 -0.821 . . . . 65.98 110.439 -173.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.2 -13.13 57.59 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.778 1.029 . . . . 41.74 113.778 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 86' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.05 122.64 67.72 Favored Pre-proline 0 C--O 1.247 0.937 0 N-CA-C 108.102 -1.073 . . . . 44.85 108.102 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.48 -21.01 72.24 Favored 'Trans proline' 0 C--O 1.238 0.52 0 CA-C-N 119.026 0.688 . . . . 97.16 113.455 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 88' ' ' THR . . . . . . . . . . . . . 99.4 m -104.49 -40.81 5.92 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 113.093 0.775 . . . . 61.02 113.093 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 89' ' ' LEU . . . . . . . . . . . . . 30.5 mt -84.78 -29.42 25.46 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 119.579 -0.848 . . . . 50.32 111.552 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.33 -41.54 94.5 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 115.045 0.778 . . . . 45.04 115.045 -172.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 91' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -54.16 -31.83 67.41 Favored 'Trans proline' 0 CA--C 1.51 -0.696 0 N-CA-C 114.191 0.804 . . . . 52.52 114.191 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 92' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -74.91 -25.26 58.8 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 112.863 0.69 . . . . 93.46 112.863 -176.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 34.4 mt -81.6 119.42 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.45 -0.574 . . . . 44.6 109.45 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 94' ' ' THR . . . . . . . . . . . . . 73.1 p -84.26 163.37 48.09 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-O 120.874 0.369 . . . . 43.55 111.189 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 95' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -55.02 -34.21 86.14 Favored 'Trans proline' 0 C--O 1.243 0.732 0 N-CA-C 113.823 0.663 . . . . 52.09 113.823 173.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 96' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -62.26 -42.86 99.7 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.967 -0.693 . . . . 55.46 111.805 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 97' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -64.88 -36.78 85.47 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.759 -0.776 . . . . 43.89 111.698 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 98' ' ' VAL . . . . . . . . . . . . . 70.7 t -61.27 -45.29 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.391 -0.924 . . . . 40.41 110.44 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 99' ' ' ARG . . . . . . . . . . . . . 13.0 mtm105 -59.39 -48.66 80.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 119.983 -0.687 . . . . 112.69 110.522 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 100' ' ' THR . . . . . . . . . . . . . 69.2 m -59.09 -49.4 78.02 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 120.935 0.398 . . . . 32.92 110.791 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.12 -41.05 95.23 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.899 -0.72 . . . . 29.97 110.79 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' SER . . . . . . . . . . . . . 42.8 p -61.69 -22.19 65.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.828 0.823 . . . . 40.58 109.871 -170.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' ARG . . . . . . . . . . . . 0.802 14.4 mtt85 -57.93 -50.19 74.21 Favored 'General case' 0 CA--C 1.476 -1.882 0 CA-C-O 123.708 1.718 . . . . 141.27 111.665 174.361 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' ILE . . . . . . . . . . . . 0.268 67.9 mt -49.82 111.77 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 112.696 -2.047 . . . . 44.09 109.047 -152.637 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 105' ' ' GLU . . . . . 0.432 ' OE1' ' N ' ' H' ' 108' ' ' GLY . 4.5 tm-20 -157.74 146.23 19.2 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.068 1.136 . . . . 91.24 114.068 -178.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 106' ' ' LEU . . . . . . . . . . . . . 20.0 tp -130.02 106.95 8.98 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.962 0.505 . . . . 70.28 110.291 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 107' ' ' ARG . . . . . . . . . . . . . 88.7 mtm-85 51.05 40.96 26.84 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.71 0.767 . . . . 96.92 111.092 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 108' ' ' GLY . . . . . 0.432 ' N ' ' OE1' ' H' ' 105' ' ' GLU . . . 88.23 -16.3 52.91 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 119.004 -0.887 . . . . 62.95 115.293 -179.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -79.07 134.32 36.75 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 118.835 1.318 . . . . 112.2 110.41 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 110' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 -132.21 161.11 64.88 Favored Pre-proline 0 C--O 1.244 0.797 0 C-N-CA 124.265 1.026 . . . . 123.95 109.277 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -52.99 149.64 26.04 Favored 'Trans proline' 0 C--N 1.33 -0.433 0 N-CA-C 109.076 -1.163 . . . . 46.72 109.076 167.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 112' ' ' ARG . . . . . . . . . . . . . 50.7 mtp85 -88.84 -76.98 0.39 Allowed 'General case' 0 C--N 1.338 0.102 0 CA-C-N 116.25 -0.432 . . . . 145.15 112.022 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 113' ' ' ASP . . . . . . . . . . . . . 27.8 p30 -106.48 175.27 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.118 1.437 . . . . 62.05 111.77 -168.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 114' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -50.16 -45.0 52.94 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 114.153 -1.385 . . . . 74.13 111.863 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 115' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' H' ' 209' ' ' HOH . 84.2 mm-40 -63.63 -36.38 83.64 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 119.54 -0.864 . . . . 55.31 111.121 -176.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -65.1 -42.96 93.53 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 112.137 0.421 . . . . 49.43 112.137 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 117' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -64.48 -41.27 96.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.84 -0.537 . . . . 35.94 111.469 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 118' ' ' TYR . . . . . 0.818 ' OH ' ' OE1' ' G' ' 115' ' ' GLN . 11.7 t80 -64.25 -40.66 96.45 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 120.139 -0.625 . . . . 53.02 110.709 179.135 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 119' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -53.88 -50.37 66.47 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 122.052 -0.405 . . . . 27.89 111.474 175.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 120' ' ' ILE . . . . . . . . . . . . . 76.5 mt -71.44 -37.61 65.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.775 0 CA-C-O 121.565 0.698 . . . . 38.41 110.966 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 121' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -57.99 -48.56 79.64 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 122.04 -0.413 . . . . 43.76 110.636 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 122' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.68 -43.89 93.84 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 120.026 -0.67 . . . . 31.83 110.897 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 123' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -69.8 -44.6 69.71 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 118.563 -1.255 . . . . 29.12 111.532 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 124' ' ' LEU . . . . . . . . . . . . . 61.1 mt -65.72 -34.66 78.7 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.443 -0.903 . . . . 28.12 111.548 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 125' ' ' LYS . . . . . 1.029 ' NZ ' ' O ' ' H' ' 201' ' ' HOH . 9.7 ttpp -63.45 -25.64 68.37 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 119.684 -0.806 . . . . 131.08 111.04 -177.16 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 -79.38 -17.08 55.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 119.104 -0.474 . . . . 56.09 112.01 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 127' ' ' ILE . . . . . . . . . . . . . 87.8 mt -102.62 -47.57 10.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 123.081 0.552 . . . . 36.32 111.996 -170.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 128' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.04 133.12 48.49 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.321 -0.862 . . . . 38.53 112.016 -169.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 129' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.26 1.628 0 CA-C-O 125.094 2.378 . . . . 61.43 112.009 -177.884 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' SO4 . . . . . 0.837 ' O3 ' ' NH2' ' C' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 201' ' ' SO4 . . . . . 0.558 ' O4 ' ' NH2' ' G' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.867 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' HOH . . . . . 1.155 ' O ' ' NH2' ' B' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' 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 ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 orig full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 301' ' ' HOH . . . . . 0.48 ' O ' ' OE1' ' E' ' 105' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 301' ' ' HOH . . . . . 0.834 ' O ' ' OG ' ' F' ' 81' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 301' ' ' HOH . . . . . 1.032 ' O ' ' NZ ' ' G' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 302' ' ' HOH . . . . . 0.835 ' O ' ' NH2' ' G' ' 110' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 201' ' ' HOH . . . . . 1.029 ' O ' ' NZ ' ' H' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 209' ' ' HOH . . . . . 0.494 ' O ' ' HG2' ' H' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 109.405 -0.591 . . . . 50.12 109.405 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.0 149.5 46.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.029 -1.081 . . . . 29.01 111.823 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.31 -44.35 92.55 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 120.39 -0.524 . . . . 27.35 111.502 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -101.18 118.27 60.57 Favored Pre-proline 0 N--CA 1.438 -1.053 0 O-C-N 121.98 -0.45 . . . . 33.33 109.925 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -57.03 142.3 94.09 Favored 'Trans proline' 0 CA--C 1.512 -0.603 0 C-N-CA 120.396 0.731 . . . . 25.67 111.212 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -66.47 -36.22 82.21 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 118.627 -1.229 . . . . 100.75 111.8 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.31 -31.85 81.8 Favored Glycine 0 C--O 1.243 0.689 0 C-N-CA 119.46 -1.352 . . . . 30.15 112.985 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.2 tp -73.03 -38.01 66.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.34 -0.944 . . . . 29.0 111.802 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 t -51.89 -44.64 63.83 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.366 -0.834 . . . . 32.25 111.183 167.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -62.23 -44.53 96.35 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 121.254 -0.904 . . . . 57.39 110.143 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.7 tp -57.49 -50.36 73.31 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 110.059 -0.348 . . . . 31.08 110.059 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.61 -38.01 77.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 121.097 0.475 . . . . 55.28 110.143 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.33 -11.28 59.82 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 121.362 -0.836 . . . . 45.37 113.028 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.77 127.05 92.8 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 109.631 -0.507 . . . . 52.44 109.631 -176.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.92 -29.49 27.91 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 114.005 0.733 . . . . 59.18 114.005 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 m -84.85 -44.93 12.78 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.728 0.695 . . . . 59.64 110.745 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . 0.439 HD22 ' CZ ' ' A' ' 118' ' ' TYR . 72.4 mt -95.92 -31.25 13.2 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 113.181 0.808 . . . . 53.77 113.181 -174.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.63 84.75 Favored Glycine 0 CA--C 1.494 -1.277 0 C-N-CA 120.648 -0.787 . . . . 47.65 114.835 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -51.09 -29.59 28.81 Favored 'Trans proline' 0 C--O 1.238 0.502 0 CA-C-N 119.799 1.8 . . . . 69.39 114.824 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -75.93 -8.53 57.15 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 113.875 1.065 . . . . 83.02 113.875 -172.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.3 mm -105.17 101.34 12.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 106.268 -1.753 . . . . 52.54 106.268 -168.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 64.9 p -67.09 158.89 79.71 Favored Pre-proline 0 N--CA 1.446 -0.659 0 C-N-CA 120.299 -0.561 . . . . 39.24 110.399 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -55.07 -35.85 91.39 Favored 'Trans proline' 0 C--O 1.235 0.36 0 N-CA-C 113.644 0.594 . . . . 38.35 113.644 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -63.95 -41.98 97.43 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.307 -0.957 . . . . 39.72 110.172 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.453 -0.899 . . . . 27.93 111.063 175.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 54.5 t -55.96 -46.84 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-O 121.661 0.743 . . . . 30.53 110.387 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 65.4 mtm-85 -73.01 -34.24 66.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.978 -1.089 . . . . 38.48 111.4 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -62.3 -50.25 72.4 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 118.4 0.545 . . . . 27.71 111.641 173.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.56 -35.83 81.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 119.658 -0.817 . . . . 23.1 111.655 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 m -62.91 -19.77 64.53 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-N 117.918 0.326 . . . . 27.99 111.207 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -88.66 2.77 52.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 117.824 -1.084 . . . . 96.89 113.474 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 89.0 mt -88.69 114.66 27.37 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 119.396 0.998 . . . . 21.21 109.156 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.2 152.7 13.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.8 -1.185 . . . . 57.02 107.8 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . 0.402 HD22 ' CZ2' ' C' ' 97' ' ' TRP . 23.3 tp -126.72 110.97 13.72 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 105.391 -2.077 . . . . 24.85 105.391 179.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 94.8 mtm-85 50.81 44.25 28.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.408 0.623 . . . . 42.53 110.932 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.45 -9.04 51.54 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 115.75 1.06 . . . . 36.5 115.75 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -86.01 128.99 34.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.438 1.119 . . . . 79.2 109.184 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -118.83 163.78 24.26 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 120.567 -0.453 . . . . 40.53 111.646 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -51.39 146.65 24.28 Favored 'Trans proline' 0 C--O 1.25 1.081 0 CA-C-O 122.758 1.066 . . . . 27.78 110.547 166.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . 0.867 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 21.2 mtm180 -85.71 -65.16 1.04 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.649 1.722 . . . . 121.81 115.649 -169.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -111.22 168.55 9.43 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 123.446 0.698 . . . . 39.09 110.22 -166.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -54.98 -40.62 70.27 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.633 -0.712 . . . . 52.73 112.526 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLN . . . . . 0.419 ' OE1' ' OH ' ' D' ' 118' ' ' TYR . 7.8 tt0 -67.56 -34.42 77.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.408 -0.917 . . . . 55.5 111.894 -178.129 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.16 -42.06 96.89 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 121.192 0.52 . . . . 26.49 109.796 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -64.98 -42.03 94.9 Favored 'General case' 0 C--N 1.351 0.665 0 C-N-CA 119.085 -1.046 . . . . 20.56 110.652 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TYR . . . . . 0.439 ' CZ ' HD22 ' A' ' 89' ' ' LEU . 17.7 t80 -65.1 -36.78 85.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 118.715 -1.194 . . . . 41.98 111.27 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -58.41 -43.9 88.82 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 116.379 -0.373 . . . . 22.5 110.402 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.14 -45.24 87.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.244 0.545 . . . . 23.12 109.962 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -59.18 -46.16 89.15 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 119.768 -0.773 . . . . 33.98 111.122 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.3 -46.65 85.74 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.798 -1.161 . . . . 29.36 110.972 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -67.9 -46.31 71.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 121.482 -0.761 . . . . 20.36 110.756 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.34 -38.07 89.73 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.168 0.509 . . . . 34.55 111.929 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.6 -39.16 92.88 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 120.787 -1.196 . . . . 68.3 110.735 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.74 -38.55 89.44 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 121.534 -0.729 . . . . 35.41 110.598 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 93.8 mt -65.74 -48.19 83.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 C-N-CA 120.767 -0.373 . . . . 30.9 110.966 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 42.2 mt -80.12 14.45 1.87 Allowed 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 112.761 0.652 . . . . 56.52 112.761 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.451 0.643 . . . . 133.88 110.51 -174.413 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . 0.431 ' OE1' ' OE2' ' B' ' 105' ' ' GLU . 4.2 pt-20 . . . . . 0 C--O 1.235 0.295 0 N-CA-C 105.971 -1.863 . . . . 107.48 105.971 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.24 149.99 49.5 Favored Glycine 0 C--O 1.251 1.188 0 C-N-CA 120.017 -1.087 . . . . 44.16 112.036 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.16 -42.21 69.34 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.256 -0.577 . . . . 61.48 110.779 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 mt -100.92 132.31 22.24 Favored Pre-proline 0 C--N 1.351 0.648 0 C-N-CA 114.238 -2.985 . . . . 44.38 111.581 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.96 142.38 43.64 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 N-CA-C 109.875 -0.856 . . . . 25.53 109.875 167.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' LYS . . . . . 1.504 ' CG ' ' CD ' ' B' ' 78' ' ' LYS . 1.8 pttp -63.64 -37.78 88.63 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 119.26 -0.976 . . . . 91.63 111.588 -175.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.65 -31.29 79.52 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 119.01 -1.567 . . . . 21.21 112.278 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.4 tp -75.76 -38.69 58.12 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 117.182 0.491 . . . . 27.4 110.311 177.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 37.9 t -57.12 -42.23 80.48 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.919 -0.712 . . . . 35.77 111.579 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.22 -39.15 91.84 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 119.937 -0.705 . . . . 36.78 110.773 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 49.8 tp -66.95 -49.11 66.5 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.898 -0.501 . . . . 27.91 111.135 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.25 -35.91 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.144 0.497 . . . . 42.03 111.96 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.63 -13.2 59.94 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 112.407 0.521 . . . . 36.37 112.407 -176.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.54 122.12 84.62 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 109.12 -0.696 . . . . 66.98 109.12 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.56 -22.25 65.14 Favored 'Trans proline' 0 C--O 1.239 0.557 0 CA-C-N 119.157 0.735 . . . . 54.15 113.802 -173.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 84.4 m -89.6 -52.09 5.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 118.594 0.634 . . . . 79.66 111.768 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.9 mt -86.11 -28.64 23.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.26 0.837 . . . . 70.24 113.26 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . -58.06 -50.25 67.81 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 116.054 1.182 . . . . 43.82 116.054 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.92 -24.84 45.52 Favored 'Trans proline' 0 C--O 1.241 0.652 0 N-CA-C 114.79 1.035 . . . . 64.67 114.79 -163.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -76.73 -16.74 59.42 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.839 0.745 . . . . 115.6 112.68 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 89.2 mt -86.47 112.04 22.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.602 -0.888 . . . . 54.2 108.602 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 69.1 p -82.6 162.51 55.49 Favored Pre-proline 0 C--O 1.239 0.508 0 CA-C-N 116.265 -0.425 . . . . 34.46 111.032 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.18 -37.5 94.18 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 120.382 0.721 . . . . 30.92 113.819 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.41 -39.78 80.66 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 118.671 -1.212 . . . . 33.61 110.646 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -72.87 -37.17 67.43 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.189 -0.604 . . . . 22.95 111.933 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 74.0 t -57.44 -44.63 84.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 120.008 -0.677 . . . . 29.33 109.738 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ARG . . . . . . . . . . . . . 1.8 tpp85 -60.36 -49.06 79.11 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 121.783 -0.573 . . . . 115.98 110.676 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 54.3 m -56.43 -50.47 71.56 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-O 121.288 0.566 . . . . 21.65 111.763 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.65 -39.33 84.6 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 121.795 -0.566 . . . . 20.32 111.716 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 81.4 p -57.12 -24.32 53.33 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 112.669 0.618 . . . . 30.0 112.669 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -89.21 5.53 44.35 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 118.666 -0.683 . . . . 37.66 112.394 -175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 96.2 mt -89.56 116.18 30.54 Favored 'Isoleucine or valine' 0 C--O 1.243 0.736 0 CA-C-N 119.281 0.946 . . . . 21.47 110.264 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' B' ' 73' ' ' GLU . 15.1 tt0 -162.62 148.82 12.69 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 107.903 -1.147 . . . . 59.67 107.903 -173.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 15.9 tp -122.51 111.06 16.36 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 106.284 -1.747 . . . . 28.06 106.284 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ARG . . . . . . . . . . . . . 6.1 mtp85 46.57 47.12 14.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.148 0.975 . . . . 34.33 111.429 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLY . . . . . . . . . . . . . . . 83.62 -5.82 76.44 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 114.988 -1.006 . . . . 38.47 114.729 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -97.44 132.72 42.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 118.678 1.239 . . . . 102.59 109.385 -177.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -118.51 151.15 49.31 Favored Pre-proline 0 C--N 1.353 0.755 0 C-N-CA 123.741 0.816 . . . . 90.48 111.358 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.34 144.81 2.76 Favored 'Trans proline' 0 C--N 1.364 1.393 0 N-CA-C 109.881 -0.853 . . . . 21.93 109.881 168.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ARG . . . . . 1.155 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 7.8 mmm180 -93.03 -48.46 6.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 112.859 0.689 . . . . 106.17 112.859 -164.446 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -123.06 169.23 11.41 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.124 -1.03 . . . . 40.88 112.758 -168.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -57.79 -37.72 74.23 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 118.401 -1.32 . . . . 45.1 111.457 -173.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' GLN . . . . . 0.416 ' OE1' ' NZ ' ' C' ' 125' ' ' LYS . 13.8 tt0 -61.83 -40.09 94.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.455 -0.498 . . . . 87.82 112.312 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -63.31 -41.64 98.95 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.139 -0.689 . . . . 28.22 109.139 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -66.86 -40.72 87.95 Favored 'General case' 0 C--O 1.25 1.103 0 O-C-N 122.06 -0.4 . . . . 18.89 111.932 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -65.03 -38.72 91.81 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 119.027 -1.069 . . . . 35.29 110.761 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -55.56 -44.48 76.85 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.343 -0.389 . . . . 23.38 111.723 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 62.7 mt -67.9 -47.67 78.3 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 123.837 0.855 . . . . 20.74 110.881 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -56.72 -49.28 75.63 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.932 -0.576 . . . . 28.62 110.664 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.71 -44.32 90.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.024 -1.471 . . . . 25.1 111.834 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -68.67 -47.25 66.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 119.4 -0.92 . . . . 19.26 110.313 -178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.06 -38.57 89.28 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.606 -0.838 . . . . 34.16 112.508 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -61.46 -37.37 83.34 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 120.565 -1.335 . . . . 56.87 111.361 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 56.7 ttm-85 -63.51 -42.28 98.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.503 -0.879 . . . . 32.8 109.846 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ILE . . . . . . . . . . . . . 87.6 mt -69.08 -43.75 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 123.554 0.534 . . . . 31.74 110.89 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -93.37 -2.73 54.43 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.902 1.075 . . . . 44.91 113.902 -170.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--N 1.324 -0.503 0 N-CA-C 106.398 -1.704 . . . . 80.12 106.398 171.206 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.508 0 N-CA-C 113.531 0.172 . . . . 80.37 113.531 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 75' ' ' ALA . . . . . . . . . . . . . . . -106.58 1.4 25.26 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.806 1.039 . . . . 59.5 113.806 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.25 157.7 47.43 Favored Pre-proline 0 C--N 1.3 -1.566 0 CA-C-N 118.538 0.608 . . . . 37.67 109.907 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.17 143.46 41.92 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 N-CA-C 109.527 -0.99 . . . . 36.59 109.527 167.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -62.05 -38.25 88.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.483 -0.887 . . . . 109.91 112.204 -173.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.55 -30.42 76.42 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 118.968 -1.587 . . . . 33.17 112.44 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 15.7 tp -74.65 -43.21 56.45 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.409 -0.465 . . . . 29.73 111.357 177.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 5.3 m -56.18 -39.03 71.77 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.677 0.275 . . . . 49.54 110.595 171.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -62.57 -44.81 95.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.202 -0.599 . . . . 41.25 110.538 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.77 -43.05 99.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.208 -0.451 . . . . 32.92 110.617 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' ILE . . . . . . . . . . . . . 19.9 mm -68.16 -32.69 57.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 120.755 -0.378 . . . . 66.39 110.322 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.06 -11.47 59.99 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 118.844 -0.598 . . . . 43.86 112.287 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -65.7 124.84 88.51 Favored Pre-proline 0 C--O 1.24 0.585 0 C-N-CA 118.859 -1.136 . . . . 46.49 108.8 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.73 -18.24 28.78 Favored 'Trans proline' 0 C--O 1.237 0.464 0 CA-C-N 119.371 0.811 . . . . 49.35 113.893 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 24.0 p -97.38 -39.65 9.09 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.495 0.924 . . . . 58.11 113.495 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.07 -29.07 19.69 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 112.708 0.633 . . . . 49.95 112.708 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.97 -49.12 56.61 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 114.617 0.607 . . . . 40.36 114.617 -172.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -59.28 -27.6 85.44 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 114.035 0.744 . . . . 48.24 114.035 -167.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 92' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -73.74 -18.55 60.97 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.741 -0.784 . . . . 97.51 112.4 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' ILE . . . . . . . . . . . . . 46.6 mt -85.47 114.41 25.37 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 108.98 -0.748 . . . . 46.6 108.98 -171.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 42.8 p -78.72 163.52 60.48 Favored Pre-proline 0 C--N 1.309 -1.184 0 CA-C-O 121.071 0.462 . . . . 36.25 109.865 -173.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.85 -36.33 97.15 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 119.91 0.406 . . . . 34.78 113.036 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -59.23 -42.42 90.98 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 117.827 0.285 . . . . 43.53 110.548 176.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' TRP . . . . . 0.402 ' CZ2' HD22 ' A' ' 106' ' ' LEU . 47.6 m95 -65.33 -39.36 92.31 Favored 'General case' 0 C--O 1.245 0.84 0 O-C-N 120.968 -1.082 . . . . 23.88 113.149 177.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 69.3 t -57.59 -46.7 86.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.538 0.685 . . . . 29.85 109.362 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' ARG . . . . . 0.503 ' HD3' ' NH2' ' C' ' 103' ' ' ARG . 3.0 ttt180 -59.9 -48.74 80.47 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.997 -0.681 . . . . 95.69 111.442 178.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 100' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -50.8 69.96 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 121.479 -0.763 . . . . 19.42 109.939 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 78.7 mt -63.86 -40.5 96.69 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 121.847 -0.533 . . . . 19.7 110.091 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 59.8 p -61.04 -18.82 59.88 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.017 -0.673 . . . . 26.71 112.499 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ARG . . . . . 0.503 ' NH2' ' HD3' ' C' ' 99' ' ' ARG . 53.1 mtt85 -89.06 2.25 54.35 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 118.224 -0.893 . . . . 87.33 112.247 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 96.6 mt -89.14 111.39 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 118.953 0.797 . . . . 23.79 108.987 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -159.74 153.6 23.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.754 0.788 . . . . 58.24 109.839 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 11.8 tp -131.34 106.01 8.0 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 105.153 -2.166 . . . . 39.59 105.153 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 107' ' ' ARG . . . . . 0.837 ' NH2' ' O3 ' ' C' ' 201' ' ' SO4 . 88.1 mtm-85 47.2 39.97 9.35 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.471 0.653 . . . . 57.06 112.414 -174.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 108' ' ' GLY . . . . . . . . . . . . . . . 82.51 -9.85 57.32 Favored Glycine 0 C--O 1.24 0.504 0 N-CA-C 115.606 1.002 . . . . 44.45 115.606 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm -78.11 134.81 37.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.841 1.32 . . . . 97.32 108.649 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' ARG . . . . . 0.522 HH11 ' HG2' ' C' ' 110' ' ' ARG . 11.6 mtt-85 -137.41 161.96 57.75 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 107.463 -1.31 . . . . 104.28 107.463 -172.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 111' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -48.7 135.82 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 124.25 1.658 . . . . 33.08 107.903 166.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' ARG . . . . . . . . . . . . . 17.7 mtt180 -91.4 -34.51 14.83 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 118.337 -1.345 . . . . 129.14 113.431 -162.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 52.7 p30 -133.65 176.09 8.86 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-O 122.048 0.928 . . . . 43.18 109.742 -176.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . 23.2 pttt -63.95 -33.71 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.386 -0.825 . . . . 61.62 111.393 -174.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -64.92 -41.52 95.48 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.78 -0.768 . . . . 57.73 111.302 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.73 -43.47 97.84 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.383 -0.927 . . . . 41.07 109.845 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 117' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -65.33 -41.67 93.71 Favored 'General case' 0 C--O 1.247 0.942 0 C-N-CA 119.7 -0.8 . . . . 27.54 112.013 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.39 -39.67 92.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.689 -0.485 . . . . 43.92 109.689 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -59.49 -47.39 85.67 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.67 -0.412 . . . . 26.26 111.869 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 10.2 tp -70.93 -38.95 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 120.566 -0.454 . . . . 30.58 110.965 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 121' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -53.37 -49.23 67.63 Favored 'General case' 0 C--O 1.243 0.757 0 O-C-N 121.46 -0.775 . . . . 29.39 111.532 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 121.014 -1.053 . . . . 23.22 110.704 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -71.34 -44.09 65.74 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.696 -1.202 . . . . 18.56 110.412 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.11 -39.26 94.18 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.731 -0.605 . . . . 24.49 111.049 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' LYS . . . . . 0.416 ' NZ ' ' OE1' ' B' ' 115' ' ' GLN . 16.0 tttt -58.21 -34.74 70.73 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.345 0.593 . . . . 116.33 111.281 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -71.79 -28.75 63.82 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.519 -0.473 . . . . 30.02 111.185 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' ILE . . . . . . . . . . . . . 92.5 mt -81.84 -41.19 18.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 118.068 0.394 . . . . 29.21 111.269 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.08 -24.88 13.15 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.884 1.809 . . . . 50.96 115.884 -168.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' SER . . . . . . . . . . . . . 43.9 p . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 120.306 1.412 . . . . 125.24 108.269 -178.22 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.489 0 CA-C-O 120.205 -0.22 . . . . 88.01 113.384 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.59 149.18 31.1 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.508 -0.553 . . . . 67.36 109.508 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 tp -106.94 112.13 63.43 Favored Pre-proline 0 C--O 1.241 0.651 0 N-CA-C 109.16 -0.681 . . . . 44.41 109.16 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' PRO . . . . . 0.436 ' HB3' ' HD3' ' D' ' 110' ' ' ARG . 32.9 Cg_exo -67.39 148.27 79.16 Favored 'Trans proline' 0 C--N 1.331 -0.382 0 C-N-CA 120.875 1.05 . . . . 36.78 111.759 177.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 78' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' D' ' 78' ' ' LYS . 1.1 tptt -69.12 -41.56 77.22 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 119.537 -0.865 . . . . 77.31 111.676 -171.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.35 93.16 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 119.719 -1.229 . . . . 32.62 114.327 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 33.5 tp -66.35 -45.03 81.58 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 121.912 -0.758 . . . . 33.09 110.656 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' SER . . . . . . . . . . . . . 36.5 t -53.76 -40.51 66.27 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.917 -0.313 . . . . 44.41 111.362 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -63.25 -42.84 99.22 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.631 -0.427 . . . . 47.72 111.454 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 23.7 tp -64.35 -45.61 87.05 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.97 -0.456 . . . . 34.66 111.412 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ILE . . . . . . . . . . . . . 40.6 mt -56.58 -39.68 64.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.682 -0.407 . . . . 43.77 111.093 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.74 -16.78 60.09 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.287 1.035 . . . . 47.02 113.61 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -57.42 121.28 46.81 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.256 -1.016 . . . . 46.78 108.256 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 87' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -68.15 -18.7 45.41 Favored 'Trans proline' 0 N--CA 1.475 0.432 0 CA-C-N 119.664 0.916 . . . . 55.65 114.327 -172.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' THR . . . . . . . . . . . . . 73.3 p -100.5 -41.77 6.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.093 0.861 . . . . 69.14 112.631 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' D' ' 92' ' ' GLN . 26.1 mt -88.07 -23.48 23.71 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.147 0.795 . . . . 46.11 113.147 -177.938 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLY . . . . . 0.421 ' N ' ' CD ' ' D' ' 91' ' ' PRO . . . -81.07 -34.36 26.94 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 116.556 1.382 . . . . 38.37 116.556 -167.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 91' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' D' ' 90' ' ' GLY . 50.9 Cg_exo -61.79 -28.04 81.29 Favored 'Trans proline' 0 C--N 1.327 -0.603 0 CA-C-N 118.951 1.375 . . . . 47.87 113.614 -173.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 92' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' D' ' 89' ' ' LEU . 20.0 pt20 -66.23 -22.1 66.32 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 118.722 -0.656 . . . . 67.72 112.361 -176.734 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 93' ' ' ILE . . . . . . . . . . . . . 2.8 mt -80.1 109.89 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.33 -0.989 . . . . 56.64 108.33 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 70.8 p -77.29 163.04 66.93 Favored Pre-proline 0 C--N 1.312 -1.041 0 N-CA-C 109.529 -0.545 . . . . 27.24 109.529 -175.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' PRO . . . . . 0.597 ' O ' ' HG3' ' D' ' 99' ' ' ARG . 61.8 Cg_exo -54.08 -38.81 87.34 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 N-CA-C 113.598 0.576 . . . . 25.36 113.598 172.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 96' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -57.91 -42.09 84.04 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 120.8 -1.188 . . . . 38.8 111.122 174.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 97' ' ' TRP . . . . . 0.408 ' CZ2' ' HA ' ' D' ' 125' ' ' LYS . 59.3 m95 -68.49 -35.65 77.82 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 121.269 -0.894 . . . . 24.85 112.416 178.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.72 -51.58 42.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 C-N-CA 119.43 -0.908 . . . . 27.89 109.934 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' ARG . . . . . 0.597 ' HG3' ' O ' ' D' ' 95' ' ' PRO . 41.4 mtp180 -61.27 -45.0 96.29 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.988 -0.685 . . . . 52.07 111.884 -177.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 100' ' ' THR . . . . . . . . . . . . . 45.2 m -62.13 -50.79 70.49 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.303 0.573 . . . . 21.9 110.838 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' LEU . . . . . . . . . . . . . 91.8 mt -66.82 -36.1 81.58 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.392 -0.818 . . . . 23.23 110.995 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' SER . . . . . . . . . . . . . 39.2 p -65.38 -14.81 61.69 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.257 -0.902 . . . . 23.91 112.343 -176.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -88.2 -1.27 57.92 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.179 0.807 . . . . 53.57 113.179 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' ILE . . . . . . . . . . . . . 78.3 mt -83.97 112.75 21.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 N-CA-C 108.99 -0.744 . . . . 27.65 108.99 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.74 151.52 18.52 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.674 -0.861 . . . . 56.1 108.674 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' LEU . . . . . . . . . . . . . 27.1 tp -122.71 113.6 19.43 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 105.916 -1.883 . . . . 28.41 105.916 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 52.04 39.05 25.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.369 0.604 . . . . 35.96 110.267 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' GLY . . . . . . . . . . . . . . . 85.64 -3.07 87.66 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-O 118.735 -1.036 . . . . 42.13 114.756 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . 3.4 mmmm -107.98 146.74 32.05 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.605 1.162 . . . . 88.69 109.692 -176.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ARG . . . . . 0.436 ' HD3' ' HB3' ' D' ' 77' ' ' PRO . 29.3 mtt-85 -127.12 164.38 35.81 Favored Pre-proline 0 C--O 1.244 0.782 0 CA-C-N 115.671 -0.695 . . . . 102.57 112.773 -169.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 111' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -44.83 137.96 8.79 Favored 'Trans proline' 0 CA--C 1.514 -0.511 0 N-CA-C 107.937 -1.601 . . . . 34.06 107.937 167.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' ARG . . . . . . . . . . . . . 55.4 mmt-85 -84.55 -37.64 20.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.453 -0.899 . . . . 96.15 112.201 -158.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 13.0 p30 -142.66 178.04 7.9 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.68 -0.637 . . . . 44.91 109.646 -170.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -53.95 -42.56 69.02 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.662 -0.699 . . . . 110.34 111.531 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -65.5 -41.46 93.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 116.477 -0.329 . . . . 57.18 110.574 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 116' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.63 -42.14 99.43 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.897 0.856 . . . . 35.69 110.646 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 117' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -67.26 -41.28 85.81 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.005 -1.059 . . . . 25.41 111.381 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' TYR . . . . . 0.419 ' OH ' ' OE1' ' A' ' 115' ' ' GLN . 9.9 t80 -62.55 -42.22 99.4 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.444 -0.503 . . . . 44.98 110.924 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.84 -45.32 90.33 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 116.471 -0.331 . . . . 23.3 111.673 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 120' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.15 -49.98 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 C-N-CA 124.553 1.141 . . . . 40.74 111.34 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 121' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -53.2 -47.36 68.98 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.65 -0.25 . . . . 31.01 111.526 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 93.2 mt -61.57 -43.98 97.86 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.862 -0.735 . . . . 26.51 111.017 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -69.25 -44.77 71.26 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 119.821 -0.752 . . . . 19.9 110.956 -178.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.83 -34.82 79.03 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 119.363 -0.935 . . . . 26.11 111.614 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' LYS . . . . . 0.408 ' HA ' ' CZ2' ' D' ' 97' ' ' TRP . 12.3 tttt -63.3 -34.71 78.28 Favored 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 121.432 -0.793 . . . . 96.34 109.922 -179.901 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -67.96 -34.94 77.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.118 -1.033 . . . . 27.3 111.188 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 127' ' ' ILE . . . . . . . . . . . . . 98.3 mt -74.8 -44.18 45.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 119.865 -0.734 . . . . 27.6 110.778 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.64 -125.14 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 106.477 -1.675 . . . . 55.4 106.477 -174.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.316 -0.89 0 C-N-CA 116.635 -2.026 . . . . 192.41 111.835 178.65 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.243 0 N-CA-C 112.195 -0.362 . . . . 82.42 112.195 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.52 154.01 19.94 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.801 0.81 . . . . 54.77 111.03 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 76' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.48 139.15 97.16 Favored Pre-proline 0 C--N 1.322 -0.612 0 C-N-CA 119.292 -0.963 . . . . 42.74 109.333 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 77' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.33 139.63 86.88 Favored 'Trans proline' 0 C--O 1.241 0.643 0 N-CA-C 110.4 -0.654 . . . . 29.22 110.4 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tptm -50.42 -50.55 51.63 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.897 0.703 . . . . 47.75 112.897 177.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.35 -32.06 82.85 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 119.548 -1.311 . . . . 23.15 111.792 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 80' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.59 -34.33 62.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 122.021 -0.693 . . . . 25.69 111.186 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 81' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' D' ' 99' ' ' ARG . 45.2 m -63.83 -33.31 75.39 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 120.154 -0.619 . . . . 31.5 111.41 171.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 82' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.16 -42.24 98.21 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.872 -0.731 . . . . 35.78 109.783 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 tp -65.87 -45.08 83.42 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.979 0.418 . . . . 43.18 110.155 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 84' ' ' ILE . . . . . . . . . . . . . 84.7 mt -58.27 -40.15 76.61 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.213 0 O-C-N 121.59 -0.694 . . . . 28.31 111.262 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.81 -3.48 56.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.923 1.082 . . . . 35.41 113.923 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 86' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.59 124.81 91.32 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 119.177 0.899 . . . . 47.26 109.316 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 87' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.33 -25.87 56.47 Favored 'Trans proline' 0 N--CA 1.475 0.423 0 CA-C-N 119.847 0.981 . . . . 60.59 114.229 -172.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 88' ' ' THR . . . . . . . . . . . . . 51.7 p -94.75 -41.82 9.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 119.257 0.935 . . . . 83.0 113.293 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 89' ' ' LEU . . . . . 0.404 HD21 HD21 ' F' ' 89' ' ' LEU . 44.2 mt -86.75 -32.13 20.57 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 114.462 1.282 . . . . 56.27 114.462 -177.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.08 -42.09 86.73 Favored Glycine 0 N--CA 1.439 -1.157 0 N-CA-C 116.21 1.244 . . . . 46.87 116.21 -174.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -55.97 -25.04 51.47 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.032 0.916 . . . . 80.01 114.051 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 92' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.59 -18.69 58.5 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.049 0.759 . . . . 130.97 113.049 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 93' ' ' ILE . . . . . . . . . . . . . 3.3 mm -95.88 88.16 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.816 -1.55 . . . . 67.06 106.816 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 94' ' ' THR . . . . . . . . . . . . . 71.4 p -60.77 161.05 16.29 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.793 -0.64 . . . . 38.48 110.206 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 95' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo -53.16 -34.67 69.98 Favored 'Trans proline' 0 N--CA 1.478 0.6 0 N-CA-C 114.248 0.826 . . . . 38.04 114.248 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 96' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -64.46 -40.92 96.62 Favored 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 119.252 -0.979 . . . . 44.84 111.72 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 97' ' ' TRP . . . . . . . . . . . . . 35.6 m95 -69.18 -33.02 72.72 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 119.681 -0.808 . . . . 30.39 110.596 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 98' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.97 -44.9 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 C-N-CA 119.342 -0.943 . . . . 40.39 110.27 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 99' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -63.88 -44.9 91.67 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.457 -0.897 . . . . 84.38 111.396 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 100' ' ' THR . . . . . . . . . . . . . 19.2 m -62.78 -44.38 96.33 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 119.331 -0.948 . . . . 27.64 110.698 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 101' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.53 -40.38 89.11 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.406 -0.361 . . . . 23.47 110.595 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 102' ' ' SER . . . . . . . . . . . . . 51.9 p -66.85 -15.26 63.5 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 120.082 -0.647 . . . . 36.25 112.092 -171.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -86.35 1.41 51.2 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 113.499 0.926 . . . . 138.0 113.499 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 104' ' ' ILE . . . . . . . . . . . . . 85.1 mt -89.88 109.84 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.048 -0.723 . . . . 31.56 109.048 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 105' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' E' ' 301' ' ' HOH . 1.1 pp20? -157.1 152.49 26.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.585 -0.894 . . . . 87.3 108.585 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 tp -132.27 104.66 6.87 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.81 -0.811 . . . . 45.61 108.81 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 107' ' ' ARG . . . . . . . . . . . . . 15.9 mmm-85 43.36 44.6 4.85 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.638 0.607 . . . . 88.66 112.638 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 108' ' ' GLY . . . . . . . . . . . . . . . 97.11 -22.45 40.68 Favored Glycine 0 N--CA 1.442 -0.956 0 CA-C-O 119.303 -0.721 . . . . 53.1 114.789 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 109' ' ' LYS . . . . . . . . . . . . . 17.3 mttp -78.43 148.99 33.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 118.145 0.973 . . . . 50.44 111.095 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 110' ' ' ARG . . . . . . . . . . . . . 32.4 ptt85 -161.56 166.26 15.08 Favored Pre-proline 0 C--O 1.244 0.793 0 N-CA-C 107.923 -1.14 . . . . 61.87 107.923 -171.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 111' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.56 153.91 74.76 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 N-CA-C 109.426 -1.029 . . . . 25.21 109.426 167.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -119.45 -40.23 2.81 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 114.358 1.244 . . . . 56.27 114.358 -169.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -121.08 173.86 7.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 119.469 1.031 . . . . 43.14 111.836 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 114' ' ' LYS . . . . . . . . . . . . . 52.7 pttt -64.45 -29.93 70.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 117.686 -1.606 . . . . 40.33 111.007 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 115' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -65.27 -43.35 91.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.001 -0.68 . . . . 90.24 111.376 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 116' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -53.67 -48.89 69.04 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 121.502 0.668 . . . . 30.06 110.401 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 117' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -66.72 -41.12 88.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.898 -0.592 . . . . 28.52 111.121 -175.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 118' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -71.25 -35.4 71.41 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.146 -0.622 . . . . 56.64 111.075 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 119' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -59.01 -45.86 89.61 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 120.912 0.387 . . . . 25.26 110.454 175.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 120' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.33 -50.01 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 122.1 -0.375 . . . . 25.32 111.024 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 121' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -48.23 -49.3 33.66 Favored 'General case' 0 C--N 1.349 0.547 0 N-CA-C 112.687 0.625 . . . . 43.03 112.687 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 122' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.57 -39.95 95.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 119.02 -1.072 . . . . 30.71 111.08 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 123' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -72.77 -41.68 64.78 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.589 0.709 . . . . 27.9 109.798 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 124' ' ' LEU . . . . . . . . . . . . . 16.2 mt -69.68 -41.33 75.6 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.953 -0.699 . . . . 53.77 111.64 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 125' ' ' LYS . . . . . . . . . . . . . 22.6 tttm -55.61 -34.68 65.09 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.412 -0.915 . . . . 110.71 110.562 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttm-85 -67.21 -29.03 68.58 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.516 -0.474 . . . . 49.22 110.303 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 127' ' ' ILE . . . . . . . . . . . . . 75.8 mt -92.0 -39.75 11.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 112.032 0.382 . . . . 51.49 112.032 -172.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 128' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 C--O 1.234 0.269 0 O-C-N 121.514 -0.741 . . . . 75.39 111.107 -179.254 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 76' ' ' LEU . . . . . 0.543 HD22 HD13 ' F' ' 80' ' ' LEU . 16.1 mt . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.018 -0.039 . . . . 47.69 110.916 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 77' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -60.08 142.37 98.24 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 O-C-N 122.166 0.561 . . . . 41.76 110.751 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 78' ' ' LYS . . . . . 0.49 ' HD3' ' OD2' ' F' ' 82' ' ' ASP . 1.0 OUTLIER -55.03 -44.75 74.93 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.593 -0.443 . . . . 53.16 112.033 -177.298 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' F' F ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.26 -25.52 72.39 Favored Glycine 0 C--O 1.248 0.99 0 C-N-CA 118.902 -1.618 . . . . 26.44 112.332 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 80' ' ' LEU . . . . . 0.543 HD13 HD22 ' F' ' 76' ' ' LEU . 3.3 tt -75.8 -47.53 25.39 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 112.445 0.535 . . . . 41.63 112.445 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 81' ' ' SER . . . . . 0.787 ' OG ' ' O ' ' F' ' 301' ' ' HOH . 25.8 t -66.57 -22.77 66.14 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 116.154 -2.219 . . . . 53.13 110.892 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 82' ' ' ASP . . . . . 0.49 ' OD2' ' HD3' ' F' ' 78' ' ' LYS . 96.6 m-20 -64.19 -42.29 96.73 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.218 -0.993 . . . . 39.95 110.7 171.974 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 83' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' F' ' 93' ' ' ILE . 41.5 tp -60.26 -45.7 92.36 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 120.02 -0.672 . . . . 31.04 111.274 174.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 84' ' ' ILE . . . . . 0.461 HD11 HD22 ' F' ' 80' ' ' LEU . 60.5 mt -58.77 -32.4 46.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 122.082 -0.386 . . . . 89.82 111.583 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.68 -4.34 59.14 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.065 1.135 . . . . 33.43 114.065 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 86' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.14 125.24 88.15 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 108.896 -0.779 . . . . 42.71 108.896 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.99 -28.2 35.63 Favored 'Trans proline' 0 C--O 1.238 0.521 0 CA-C-N 119.238 0.764 . . . . 56.01 112.62 -176.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 88' ' ' THR . . . . . . . . . . . . . 54.5 m -81.38 -53.24 6.48 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.195 -0.315 . . . . 64.64 111.358 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 89' ' ' LEU . . . . . 0.404 HD21 HD21 ' E' ' 89' ' ' LEU . 20.8 mt -90.17 -22.87 21.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.705 1.002 . . . . 59.39 113.705 -173.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 90' ' ' GLY . . . . . 0.403 ' N ' ' CD ' ' F' ' 91' ' ' PRO . . . -64.6 -45.66 92.33 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 115.263 0.865 . . . . 39.57 115.263 -173.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 91' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' F' ' 90' ' ' GLY . 31.6 Cg_exo -62.1 -21.07 71.8 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 117.942 0.871 . . . . 56.89 113.1 -173.332 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.05 -20.6 64.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 112.558 0.577 . . . . 137.39 112.558 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 93' ' ' ILE . . . . . 0.525 HD12 ' HG ' ' F' ' 83' ' ' LEU . 21.6 mt -100.22 105.93 18.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.147 -0.686 . . . . 61.73 109.147 -163.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 94' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 162.65 72.88 Favored Pre-proline 0 C--O 1.242 0.678 0 CA-C-N 115.595 -0.729 . . . . 45.77 110.54 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.38 -37.93 62.02 Favored 'Trans proline' 0 C--O 1.24 0.583 0 O-C-N 122.082 0.517 . . . . 65.53 113.338 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 96' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -63.45 -39.95 95.83 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.316 -0.554 . . . . 54.64 110.771 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 97' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -67.0 -39.43 87.13 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 120.689 -0.404 . . . . 31.53 111.696 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 98' ' ' VAL . . . . . . . . . . . . . 97.6 t -54.65 -48.91 71.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 119.886 -0.726 . . . . 41.09 110.57 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 99' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -62.16 -44.96 95.47 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.884 -0.726 . . . . 87.57 111.104 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 100' ' ' THR . . . . . . . . . . . . . 18.0 m -59.48 -46.61 88.32 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 121.773 -0.58 . . . . 30.18 111.041 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 101' ' ' LEU . . . . . . . . . . . . . 72.6 mt -68.65 -37.98 80.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.25 -0.58 . . . . 23.4 111.42 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 102' ' ' SER . . . . . . . . . . . . . 67.6 p -62.72 -20.72 65.19 Favored 'General case' 0 C--N 1.348 0.526 0 CA-C-N 118.517 0.599 . . . . 38.84 111.695 -175.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 103' ' ' ARG . . . . . 0.604 ' O ' ' HD2' ' F' ' 103' ' ' ARG . 8.8 tmm_? -83.69 1.01 44.61 Favored 'General case' 0 C--O 1.247 0.94 0 N-CA-C 114.743 1.386 . . . . 118.22 114.743 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 104' ' ' ILE . . . . . . . . . . . . . 84.0 mt -85.58 106.34 15.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 107.552 -1.277 . . . . 30.41 107.552 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 105' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.22 146.13 10.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.89 -1.522 . . . . 107.81 106.89 -170.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tp -138.96 92.76 2.63 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.586 -1.264 . . . . 64.76 107.586 -175.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 107' ' ' ARG . . . . . . . . . . . . . 19.2 mtp85 45.51 46.41 10.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.654 0.74 . . . . 101.66 111.049 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.39 -15.39 63.36 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 115.095 0.798 . . . . 48.63 115.095 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 109' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -81.17 142.44 33.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 118.021 0.911 . . . . 83.37 109.873 172.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 ptt-85 -154.35 163.82 22.88 Favored Pre-proline 0 C--O 1.248 0.989 0 N-CA-C 108.905 -0.776 . . . . 79.54 108.905 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 111' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.11 151.78 48.69 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 121.517 1.478 . . . . 27.0 108.289 165.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 112' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -119.26 -15.51 9.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 115.487 1.662 . . . . 67.56 115.487 -161.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -151.74 176.64 11.2 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 119.297 0.953 . . . . 43.99 108.53 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -61.16 -38.7 87.38 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.189 -0.914 . . . . 54.5 110.988 -173.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 115' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -65.66 -38.78 90.27 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 119.539 -0.864 . . . . 84.1 110.629 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 116' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -58.6 -46.61 86.64 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.551 0.691 . . . . 34.39 110.867 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 117' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -66.99 -38.77 86.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 121.87 -0.519 . . . . 23.96 111.253 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 118' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -67.73 -38.82 84.06 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 118.713 -1.195 . . . . 52.24 111.543 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 119' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -55.9 -48.17 76.12 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.93 0.395 . . . . 29.39 110.281 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 120' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.31 -49.5 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.119 0 CA-C-O 121.399 0.619 . . . . 26.15 110.213 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 121' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -50.22 -50.85 48.36 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 121.645 -0.659 . . . . 35.63 111.628 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 122' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.01 -41.81 98.47 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.949 -0.7 . . . . 29.75 110.887 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 123' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -69.34 -48.12 62.36 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 119.248 -0.981 . . . . 21.21 110.323 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 mt -61.3 -39.06 89.05 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.485 -0.486 . . . . 30.54 110.939 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -60.97 -36.33 79.13 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.473 0.654 . . . . 69.03 111.108 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 126' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -71.66 -37.07 70.84 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 122.053 -0.404 . . . . 39.96 111.108 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 127' ' ' ILE . . . . . . . . . . . . . 73.7 mt -71.69 -37.46 62.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-O 120.875 0.369 . . . . 51.24 110.25 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 128' ' ' LEU . . . . . . . . . . . . . 31.3 mt . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 109.633 -0.506 . . . . 52.41 109.633 -178.96 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 119.468 -0.301 . . . . 53.33 111.436 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 76' ' ' LEU . . . . . . . . . . . . . 12.3 mt -74.8 147.48 84.18 Favored Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 120.361 -0.535 . . . . 53.08 110.899 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -51.15 141.67 37.82 Favored 'Trans proline' 0 C--O 1.237 0.455 0 N-CA-C 109.777 -0.894 . . . . 43.75 109.777 167.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -55.72 -40.54 72.6 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.809 -0.632 . . . . 88.95 111.897 -174.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.94 -31.05 79.64 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.551 -1.309 . . . . 31.1 113.039 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 80' ' ' LEU . . . . . . . . . . . . . 41.5 mt -77.2 -36.36 54.95 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 118.627 -1.229 . . . . 40.86 110.894 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 81' ' ' SER . . . . . . . . . . . . . 11.8 t -60.34 -39.11 85.93 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 119.057 -1.057 . . . . 49.31 109.724 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 82' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -66.1 -40.44 90.77 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.436 -0.906 . . . . 43.63 111.474 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 83' ' ' LEU . . . . . 0.44 HD23 ' C ' ' G' ' 83' ' ' LEU . 18.0 tp -60.18 -43.72 95.65 Favored 'General case' 0 C--N 1.347 0.481 0 CA-C-O 120.932 0.396 . . . . 32.07 110.857 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 84' ' ' ILE . . . . . . . . . . . . . 31.8 pt -73.54 -15.1 16.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.774 0 C-N-CA 119.245 -0.982 . . . . 34.67 112.119 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.57 -2.8 44.21 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.841 0.682 . . . . 31.57 112.841 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 86' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -82.77 129.35 62.42 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.256 -0.646 . . . . 40.1 109.256 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 87' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.22 -23.31 45.44 Favored 'Trans proline' 0 CA--C 1.498 -1.32 0 CA-C-O 118.293 -0.795 . . . . 38.11 113.799 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 88' ' ' THR . . . . . . . . . . . . . 36.9 m -87.83 -46.39 9.47 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 119.442 1.019 . . . . 30.76 111.578 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 89' ' ' LEU . . . . . 0.412 ' HB3' HD11 ' G' ' 83' ' ' LEU . 66.3 mt -88.16 -34.78 17.72 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 113.628 0.973 . . . . 33.36 113.628 -174.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.1 -47.7 32.76 Favored Glycine 0 N--CA 1.44 -1.042 0 C-N-CA 125.149 1.357 . . . . 25.81 115.593 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 91' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -71.91 -9.08 24.17 Favored 'Trans proline' 0 C--O 1.245 0.861 0 CA-C-N 119.06 1.43 . . . . 26.19 114.369 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 92' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -97.85 -2.84 39.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 112.958 0.725 . . . . 71.5 112.958 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 93' ' ' ILE . . . . . . . . . . . . . 19.5 tt -123.83 146.09 29.84 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.551 -0.907 . . . . 29.67 108.551 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 94' ' ' THR . . . . . . . . . . . . . 42.5 p -94.0 160.11 32.98 Favored Pre-proline 0 C--N 1.307 -1.244 0 CA-C-N 115.654 -0.703 . . . . 35.71 111.225 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.34 -38.04 92.35 Favored 'Trans proline' 0 C--O 1.241 0.668 0 N-CA-C 114.435 0.898 . . . . 33.92 114.435 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 96' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.92 -40.68 89.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.155 0.502 . . . . 82.9 111.297 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 97' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -64.97 -39.73 93.92 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.469 -0.77 . . . . 26.07 110.978 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 98' ' ' VAL . . . . . . . . . . . . . 90.5 t -56.91 -48.53 81.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 C-N-CA 120.157 -0.617 . . . . 30.69 111.141 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 99' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -57.45 -47.27 82.25 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.371 -0.831 . . . . 153.61 111.575 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 100' ' ' THR . . . . . . . . . . . . . 26.0 m -56.81 -48.11 78.7 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.648 0.737 . . . . 29.3 111.395 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.2 -36.19 83.4 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 121.639 -0.663 . . . . 27.88 110.638 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 102' ' ' SER . . . . . . . . . . . . . 32.7 p -61.52 -17.09 53.22 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.196 -0.602 . . . . 30.54 111.595 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 103' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -88.29 4.05 47.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.931 1.086 . . . . 92.18 113.931 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 104' ' ' ILE . . . . . . . . . . . . . 94.8 mt -90.67 118.07 35.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 119.867 1.212 . . . . 29.64 109.476 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -160.88 153.17 20.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.737 0.415 . . . . 100.31 110.046 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 106' ' ' LEU . . . . . 0.449 HD23 ' HE3' ' G' ' 109' ' ' LYS . 6.7 tp -137.63 101.53 4.5 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 106.295 -1.743 . . . . 53.03 106.295 176.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 107' ' ' ARG . . . . . 1.5 ' CB ' ' CG ' ' G' ' 107' ' ' ARG 0.278 19.2 mmt180 61.31 31.95 19.28 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.238 -0.914 . . . . 64.27 112.451 175.077 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' G' G ' 108' ' ' GLY . . . . . . . . . . . . . . . 93.16 -18.24 56.62 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 118.45 -1.833 . . . . 49.55 114.896 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 109' ' ' LYS . . . . . 0.449 ' HE3' HD23 ' G' ' 106' ' ' LEU . 7.7 mtmt -83.83 134.15 34.72 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 119.126 1.463 . . . . 86.01 110.497 178.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 110' ' ' ARG . . . . . 0.835 ' NH2' ' O ' ' G' ' 302' ' ' HOH . 6.8 mtm-85 -139.29 155.75 72.15 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 106.449 -1.685 . . . . 156.79 106.449 -175.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 111' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.07 148.05 25.13 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 N-CA-C 109.219 -1.108 . . . . 38.24 109.219 166.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 112' ' ' ARG . . . . . 0.414 HH12 ' HB2' ' G' ' 110' ' ' ARG . 45.4 mmt-85 -101.19 -65.03 1.0 Allowed 'General case' 0 C--O 1.234 0.242 0 C-N-CA 118.416 -1.314 . . . . 163.32 113.598 -172.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -97.69 169.59 9.58 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 123.08 1.419 . . . . 66.91 112.464 -172.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -60.72 -38.17 84.19 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-N 114.458 -1.247 . . . . 44.71 111.097 -171.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 115' ' ' GLN . . . . . 0.818 ' OE1' ' OH ' ' H' ' 118' ' ' TYR . 25.5 mp0 -67.29 -32.92 74.24 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-O 121.038 0.447 . . . . 59.71 111.608 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 116' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.34 -43.16 91.75 Favored 'General case' 0 C--O 1.245 0.834 0 CA-C-O 120.861 0.362 . . . . 43.19 111.146 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 117' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -62.37 -39.23 92.49 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.351 -0.539 . . . . 29.2 110.987 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 118' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.79 -38.53 80.05 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.096 -0.642 . . . . 34.83 110.925 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 119' ' ' GLU . . . . . . . . . . . . . 53.3 tt0 -57.27 -48.44 78.88 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.7 0.762 . . . . 27.34 109.829 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 120' ' ' ILE . . . . . . . . . . . . . 50.8 mt -63.17 -45.65 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.659 -0.651 . . . . 62.53 111.145 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 121' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -53.58 -50.76 64.9 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.184 0.439 . . . . 28.6 112.184 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 122' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.05 -42.66 90.8 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.565 -0.454 . . . . 22.78 110.624 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 123' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -68.08 -46.55 70.7 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.285 -0.885 . . . . 20.03 111.566 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 124' ' ' LEU . . . . . . . . . . . . . 20.5 mt -63.88 -36.14 82.97 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.853 -0.529 . . . . 27.35 111.641 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 125' ' ' LYS . . . . . 0.863 ' NZ ' ' O ' ' G' ' 301' ' ' HOH . 1.6 pttp -63.08 -29.09 70.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 119.714 -0.794 . . . . 86.63 111.72 -178.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 126' ' ' ARG . . . . . . . . . . . . . 39.7 ttm-85 -72.24 -16.46 61.93 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 113.509 0.929 . . . . 42.94 113.509 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 127' ' ' ILE . . . . . . . . . . . . . 96.6 mt -105.09 -49.77 9.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 112.736 0.643 . . . . 28.47 112.736 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 128' ' ' LEU . . . . . . . . . . . . . 9.7 mp -63.37 134.6 56.01 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.981 -1.075 . . . . 36.54 112.217 -171.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 129' ' ' SER . . . . . . . . . . . . . 59.9 p . . . . . 0 C--O 1.258 1.536 0 N-CA-C 113.014 0.746 . . . . 39.01 113.014 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 120.97 0.414 . . . . 56.7 111.162 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 76' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 149.2 97.28 Favored Pre-proline 0 C--N 1.327 -0.386 0 C-N-CA 118.948 -1.101 . . . . 53.81 109.635 167.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 77' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -54.43 142.64 69.41 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 109.034 -1.179 . . . . 37.58 109.034 170.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 78' ' ' LYS . . . . . 0.429 ' HB2' ' HE2' ' H' ' 78' ' ' LYS . 0.8 OUTLIER -65.91 -35.04 79.53 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.456 -0.498 . . . . 92.75 111.616 -169.731 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' H' H ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.74 -32.21 82.26 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.071 -1.537 . . . . 30.45 112.955 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 80' ' ' LEU . . . . . . . . . . . . . 34.1 tp -75.75 -38.97 57.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.557 -0.967 . . . . 29.53 109.675 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -57.79 -41.62 82.48 Favored 'General case' 0 C--O 1.251 1.147 0 C-N-CA 119.48 -0.888 . . . . 37.53 110.741 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 82' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -62.29 -44.71 95.89 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 120.232 -1.543 . . . . 43.9 111.103 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.25 -45.4 83.99 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.934 0.397 . . . . 38.01 111.523 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 84' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.46 -24.16 21.7 Favored 'Isoleucine or valine' 0 C--O 1.243 0.735 0 C-N-CA 119.648 -0.821 . . . . 54.97 110.439 -173.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.2 -13.13 57.59 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.778 1.029 . . . . 36.99 113.778 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 86' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.05 122.64 67.72 Favored Pre-proline 0 C--O 1.247 0.937 0 N-CA-C 108.102 -1.073 . . . . 42.0 108.102 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.48 -21.01 72.24 Favored 'Trans proline' 0 C--O 1.238 0.52 0 CA-C-N 119.026 0.688 . . . . 80.95 113.455 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 88' ' ' THR . . . . . . . . . . . . . 99.4 m -104.49 -40.81 5.92 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 113.093 0.775 . . . . 50.83 113.093 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 89' ' ' LEU . . . . . . . . . . . . . 30.5 mt -84.78 -29.42 25.46 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 119.579 -0.848 . . . . 42.68 111.552 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.33 -41.54 94.5 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 115.045 0.778 . . . . 37.52 115.045 -172.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 91' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -54.16 -31.83 67.41 Favored 'Trans proline' 0 CA--C 1.51 -0.696 0 N-CA-C 114.191 0.804 . . . . 47.24 114.191 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 92' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -74.91 -25.26 58.8 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 112.863 0.69 . . . . 93.35 112.863 -176.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 34.4 mt -81.6 119.42 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.45 -0.574 . . . . 37.15 109.45 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 94' ' ' THR . . . . . . . . . . . . . 73.1 p -84.26 163.37 48.09 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-O 120.874 0.369 . . . . 36.28 111.189 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 95' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -55.02 -34.21 86.14 Favored 'Trans proline' 0 C--O 1.243 0.732 0 N-CA-C 113.823 0.663 . . . . 43.39 113.823 173.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 96' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -62.26 -42.86 99.7 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.967 -0.693 . . . . 55.46 111.805 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 97' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -64.88 -36.78 85.47 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.759 -0.776 . . . . 36.56 111.698 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 98' ' ' VAL . . . . . . . . . . . . . 70.7 t -61.27 -45.29 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.391 -0.924 . . . . 33.65 110.44 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 99' ' ' ARG . . . . . . . . . . . . . 13.0 mtm105 -59.39 -48.66 80.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 119.983 -0.687 . . . . 93.89 110.522 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 100' ' ' THR . . . . . . . . . . . . . 69.2 m -59.09 -49.4 78.02 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 120.935 0.398 . . . . 27.42 110.791 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.12 -41.05 95.23 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.899 -0.72 . . . . 24.96 110.79 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' SER . . . . . . . . . . . . . 42.8 p -61.69 -22.19 65.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.828 0.823 . . . . 36.04 109.871 -170.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 103' ' ' ARG . . . . . . . . . . . . 0.802 14.4 mtt85 -57.93 -50.19 74.21 Favored 'General case' 0 CA--C 1.476 -1.882 0 CA-C-O 123.708 1.718 . . . . 117.71 111.665 174.361 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 104' ' ' ILE . . . . . . . . . . . . 0.268 67.9 mt -49.82 111.77 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 112.696 -2.047 . . . . 37.9 109.047 -152.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -157.74 146.23 19.2 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.068 1.136 . . . . 91.24 114.068 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 106' ' ' LEU . . . . . . . . . . . . . 20.0 tp -130.02 106.95 8.98 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.962 0.505 . . . . 58.54 110.291 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 107' ' ' ARG . . . . . . . . . . . . . 88.7 mtm-85 51.05 40.96 26.84 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.71 0.767 . . . . 80.74 111.092 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 108' ' ' GLY . . . . . . . . . . . . . . . 88.23 -16.3 52.91 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 119.004 -0.887 . . . . 57.99 115.293 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -79.07 134.32 36.75 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 118.835 1.318 . . . . 93.48 110.41 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 110' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 -132.21 161.11 64.88 Favored Pre-proline 0 C--O 1.244 0.797 0 C-N-CA 124.265 1.026 . . . . 103.27 109.277 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -52.99 149.64 26.04 Favored 'Trans proline' 0 C--N 1.33 -0.433 0 N-CA-C 109.076 -1.163 . . . . 43.45 109.076 167.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 112' ' ' ARG . . . . . . . . . . . . . 50.7 mtp85 -88.84 -76.98 0.39 Allowed 'General case' 0 C--N 1.338 0.102 0 CA-C-N 116.25 -0.432 . . . . 120.94 112.022 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 113' ' ' ASP . . . . . . . . . . . . . 27.8 p30 -106.48 175.27 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.118 1.437 . . . . 62.05 111.77 -168.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 114' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -50.16 -45.0 52.94 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 114.153 -1.385 . . . . 61.76 111.863 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 115' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' H' ' 209' ' ' HOH . 84.2 mm-40 -63.63 -36.38 83.64 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 119.54 -0.864 . . . . 46.07 111.121 -176.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -65.1 -42.96 93.53 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 112.137 0.421 . . . . 49.43 112.137 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 117' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -64.48 -41.27 96.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.84 -0.537 . . . . 29.93 111.469 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 118' ' ' TYR . . . . . 0.818 ' OH ' ' OE1' ' G' ' 115' ' ' GLN . 11.7 t80 -64.25 -40.66 96.45 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 120.139 -0.625 . . . . 44.16 110.709 179.135 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 119' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -53.88 -50.37 66.47 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 122.052 -0.405 . . . . 23.22 111.474 175.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 120' ' ' ILE . . . . . . . . . . . . . 76.5 mt -71.44 -37.61 65.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.775 0 CA-C-O 121.565 0.698 . . . . 31.99 110.966 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 121' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -57.99 -48.56 79.64 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 122.04 -0.413 . . . . 36.45 110.636 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 122' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.68 -43.89 93.84 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 120.026 -0.67 . . . . 26.51 110.897 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 123' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -69.8 -44.6 69.71 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 118.563 -1.255 . . . . 24.25 111.532 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 124' ' ' LEU . . . . . . . . . . . . . 61.1 mt -65.72 -34.66 78.7 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.443 -0.903 . . . . 23.41 111.548 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 125' ' ' LYS . . . . . 1.029 ' NZ ' ' O ' ' H' ' 201' ' ' HOH . 9.7 ttpp -63.45 -25.64 68.37 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 119.684 -0.806 . . . . 109.22 111.04 -177.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 -79.38 -17.08 55.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 119.104 -0.474 . . . . 46.73 112.01 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 127' ' ' ILE . . . . . . . . . . . . . 87.8 mt -102.62 -47.57 10.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 123.081 0.552 . . . . 36.32 111.996 -170.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 128' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.04 133.12 48.49 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.321 -0.862 . . . . 32.24 112.016 -169.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 129' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.26 1.628 0 CA-C-O 125.094 2.378 . . . . 51.17 112.009 -177.884 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' SO4 . . . . . 0.837 ' O3 ' ' NH2' ' C' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 201' ' ' SO4 . . . . . 0.558 ' O4 ' ' NH2' ' G' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.867 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' HOH . . . . . 1.155 ' O ' ' NH2' ' B' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 217' ' ' 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 ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 build full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 301' ' ' HOH . . . . . 0.48 ' O ' ' OE1' ' E' ' 105' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 301' ' ' HOH . . . . . 0.787 ' O ' ' OG ' ' F' ' 81' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 301' ' ' HOH . . . . . 0.863 ' O ' ' NZ ' ' G' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 302' ' ' HOH . . . . . 0.835 ' O ' ' NH2' ' G' ' 110' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 201' ' ' HOH . . . . . 1.029 ' O ' ' NZ ' ' H' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 209' ' ' HOH . . . . . 0.478 ' O ' ' HG2' ' H' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 23.4 pt-20 . . . . . 0 CA--C 1.543 0.69 0 N-CA-C 109.405 -0.591 . . . . 50.119999999999997 109.405 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . -71.0 149.5 46.18 Favored Glycine 0 N--CA 1.448 -0.559 0 C-N-CA 120.029 -1.081 . . . . 29.010000000000002 111.823 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -59.31 -44.35 92.55 Favored 'General case' 0 C--O 1.246 0.894 0 C-N-CA 120.39 -0.524 . . . . 27.350000000000001 111.502 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.7 tp -101.18 118.27 60.57 Favored Pre-proline 0 N--CA 1.438 -1.053 0 O-C-N 121.98 -0.45 . . . . 33.329999999999998 109.925 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_exo -57.03 142.3 94.09 Favored 'Trans proline' 0 CA--C 1.512 -0.603 0 C-N-CA 120.396 0.731 . . . . 25.670000000000002 111.212 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -66.47 -36.22 82.21 Favored 'General case' 0 C--N 1.329 -0.286 0 C-N-CA 118.627 -1.229 . . . . 100.75 111.8 -175.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.31 -31.85 81.8 Favored Glycine 0 C--O 1.243 0.689 0 C-N-CA 119.46 -1.352 . . . . 30.149999999999999 112.985 175.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 34.2 tp -73.03 -38.01 66.7 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 119.34 -0.944 . . . . 29.0 111.802 175.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.8 t -51.89 -44.64 63.83 Favored 'General case' 0 C--O 1.244 0.801 0 O-C-N 121.366 -0.834 . . . . 32.25 111.183 167.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -62.23 -44.53 96.35 Favored 'General case' 0 C--O 1.242 0.665 0 O-C-N 121.254 -0.904 . . . . 57.390000000000001 110.143 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 40.7 tp -57.49 -50.36 73.31 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 110.059 -0.348 . . . . 31.079999999999998 110.059 177.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 62.5 mt -60.61 -38.01 77.11 Favored 'Isoleucine or valine' 0 C--O 1.241 0.631 0 CA-C-O 121.097 0.475 . . . . 55.280000000000001 110.143 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -77.33 -11.28 59.82 Favored 'General case' 0 C--O 1.238 0.466 0 O-C-N 121.362 -0.836 . . . . 45.369999999999997 113.028 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -69.77 127.05 92.8 Favored Pre-proline 0 C--O 1.237 0.411 0 N-CA-C 109.631 -0.507 . . . . 52.439999999999998 109.631 -176.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_endo -68.92 -29.49 27.91 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 114.005 0.733 . . . . 59.18 114.005 -173.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.2 m -84.85 -44.93 12.78 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 118.728 0.695 . . . . 59.640000000000001 110.745 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.439 HD22 ' CZ ' ' A' ' 118' ' ' TYR . 72.4 mt -95.92 -31.25 13.2 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 113.181 0.808 . . . . 53.770000000000003 113.181 -174.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -55.36 -43.63 84.75 Favored Glycine 0 CA--C 1.494 -1.277 0 C-N-CA 120.648 -0.787 . . . . 47.649999999999999 114.835 -175.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -51.09 -29.59 28.81 Favored 'Trans proline' 0 C--O 1.238 0.502 0 CA-C-N 119.799 1.8 . . . . 69.390000000000001 114.824 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 40.2 mt-30 -75.93 -8.53 57.15 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 113.875 1.065 . . . . 83.019999999999996 113.875 -172.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ILE . . . . . . . . . . . . . 8.3 mm -105.17 101.34 12.22 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 N-CA-C 106.268 -1.753 . . . . 52.539999999999999 106.268 -168.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' THR . . . . . . . . . . . . . 64.9 p -67.09 158.89 79.71 Favored Pre-proline 0 N--CA 1.446 -0.659 0 C-N-CA 120.299 -0.561 . . . . 39.240000000000002 110.399 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_exo -55.07 -35.85 91.39 Favored 'Trans proline' 0 C--O 1.235 0.36 0 N-CA-C 113.644 0.594 . . . . 38.350000000000001 113.644 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 71.4 m-20 -63.95 -41.98 97.43 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 119.307 -0.957 . . . . 39.719999999999999 110.172 177.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -61.24 -39.69 91.25 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 119.453 -0.899 . . . . 27.93 111.063 175.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 54.5 t -55.96 -46.84 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 CA-C-O 121.661 0.743 . . . . 30.530000000000001 110.387 177.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 65.4 mtm-85 -73.01 -34.24 66.25 Favored 'General case' 0 C--N 1.319 -0.733 0 C-N-CA 118.978 -1.089 . . . . 38.479999999999997 111.4 -176.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -62.3 -50.25 72.4 Favored 'General case' 0 C--O 1.24 0.595 0 CA-C-N 118.4 0.545 . . . . 27.710000000000001 111.641 173.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.0 mt -63.56 -35.83 81.8 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 119.658 -0.817 . . . . 23.100000000000001 111.655 179.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 37.6 m -62.91 -19.77 64.53 Favored 'General case' 0 C--O 1.249 1.054 0 CA-C-N 117.918 0.326 . . . . 27.989999999999998 111.207 -174.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ARG . . . . . . . . . . . . . 57.6 mtp180 -88.66 2.77 52.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-O 117.824 -1.084 . . . . 96.890000000000001 113.474 -178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 89.0 mt -88.69 114.66 27.37 Favored 'Isoleucine or valine' 0 C--O 1.239 0.526 0 CA-C-N 119.396 0.998 . . . . 21.210000000000001 109.156 -178.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.2 152.7 13.05 Favored 'General case' 0 N--CA 1.447 -0.6 0 N-CA-C 107.8 -1.185 . . . . 57.020000000000003 107.8 179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . 0.402 HD22 ' CZ2' ' C' ' 97' ' ' TRP . 23.3 tp -126.72 110.97 13.72 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 105.391 -2.077 . . . . 24.850000000000001 105.391 179.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 94.8 mtm-85 50.81 44.25 28.04 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.408 0.623 . . . . 42.530000000000001 110.932 179.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.45 -9.04 51.54 Favored Glycine 0 C--O 1.24 0.523 0 N-CA-C 115.75 1.06 . . . . 36.5 115.75 179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 71.8 tttt -86.01 128.99 34.97 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 118.438 1.119 . . . . 79.200000000000003 109.184 179.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 3.6 mtt180 -118.83 163.78 24.26 Favored Pre-proline 0 N--CA 1.447 -0.614 0 C-N-CA 120.567 -0.453 . . . . 40.530000000000001 111.646 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -51.39 146.65 24.28 Favored 'Trans proline' 0 C--O 1.25 1.081 0 CA-C-O 122.758 1.066 . . . . 27.780000000000001 110.547 166.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . 0.867 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 21.2 mtm180 -85.71 -65.16 1.04 Allowed 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 115.649 1.722 . . . . 121.81 115.649 -169.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 73.5 m-20 -111.22 168.55 9.43 Favored 'General case' 0 C--O 1.25 1.131 0 C-N-CA 123.446 0.698 . . . . 39.090000000000003 110.22 -166.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 62.6 pttt -54.98 -40.62 70.27 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.633 -0.712 . . . . 52.729999999999997 112.526 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLN . . . . . 0.419 ' OE1' ' OH ' ' D' ' 118' ' ' TYR . 7.8 tt0 -67.56 -34.42 77.02 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.408 -0.917 . . . . 55.5 111.894 -178.129 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 50.5 m-20 -64.16 -42.06 96.89 Favored 'General case' 0 C--O 1.247 0.941 0 CA-C-O 121.192 0.52 . . . . 26.489999999999998 109.796 177.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TRP . . . . . . . . . . . . . 74.8 m95 -64.98 -42.03 94.9 Favored 'General case' 0 C--N 1.351 0.665 0 C-N-CA 119.085 -1.046 . . . . 20.559999999999999 110.652 177.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TYR . . . . . 0.439 ' CZ ' HD22 ' A' ' 89' ' ' LEU . 17.7 t80 -65.1 -36.78 85.38 Favored 'General case' 0 C--O 1.239 0.55 0 C-N-CA 118.715 -1.194 . . . . 41.979999999999997 111.27 -178.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -58.41 -43.9 88.82 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 116.379 -0.373 . . . . 22.5 110.402 176.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ILE . . . . . . . . . . . . . 62.9 mt -67.14 -45.24 87.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 CA-C-O 121.244 0.545 . . . . 23.120000000000001 109.962 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 20.7 t80 -59.18 -46.16 89.15 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 119.768 -0.773 . . . . 33.979999999999997 111.122 -176.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 82.9 mt -58.3 -46.65 85.74 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 118.798 -1.161 . . . . 29.359999999999999 110.972 -178.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -67.9 -46.31 71.97 Favored 'General case' 0 N--CA 1.451 -0.379 0 O-C-N 121.482 -0.761 . . . . 20.359999999999999 110.756 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.34 -38.07 89.73 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.168 0.509 . . . . 34.549999999999997 111.929 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 20.2 tttt -62.6 -39.16 92.88 Favored 'General case' 0 C--O 1.24 0.586 0 O-C-N 120.787 -1.196 . . . . 68.299999999999997 110.735 179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 51.2 ttm-85 -65.74 -38.55 89.44 Favored 'General case' 0 N--CA 1.444 -0.765 0 O-C-N 121.534 -0.729 . . . . 35.409999999999997 110.598 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ILE . . . . . . . . . . . . . 93.8 mt -65.74 -48.19 83.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 C-N-CA 120.767 -0.373 . . . . 30.899999999999999 110.966 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 42.2 mt -80.12 14.45 1.87 Allowed 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 112.761 0.652 . . . . 56.520000000000003 112.761 -178.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--N 1.329 -0.305 0 CA-C-O 121.451 0.643 . . . . 133.88 110.51 -174.413 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . 0.431 ' OE1' ' OE2' ' B' ' 105' ' ' GLU . 4.2 pt-20 . . . . . 0 C--O 1.235 0.295 0 N-CA-C 105.971 -1.863 . . . . 107.48 105.971 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLY . . . . . . . . . . . . . . . -63.24 149.99 49.5 Favored Glycine 0 C--O 1.251 1.188 0 C-N-CA 120.017 -1.087 . . . . 44.159999999999997 112.036 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . -54.16 -42.21 69.34 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 120.256 -0.577 . . . . 61.479999999999997 110.779 176.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 10.4 mt -100.92 132.31 22.24 Favored Pre-proline 0 C--N 1.351 0.648 0 C-N-CA 114.238 -2.985 . . . . 44.380000000000003 111.581 170.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -51.96 142.38 43.64 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 N-CA-C 109.875 -0.856 . . . . 25.530000000000001 109.875 167.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' LYS . . . . . 1.504 ' CD ' ' CG ' ' B' ' 78' ' ' LYS . 1.8 pttp -63.64 -37.78 88.63 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 119.26 -0.976 . . . . 91.629999999999995 111.588 -175.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.65 -31.29 79.52 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 119.01 -1.567 . . . . 21.210000000000001 112.278 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 32.4 tp -75.76 -38.69 58.12 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 117.182 0.491 . . . . 27.399999999999999 110.311 177.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 37.9 t -57.12 -42.23 80.48 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 119.919 -0.712 . . . . 35.770000000000003 111.579 169.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . 97.9 m-20 -62.22 -39.15 91.84 Favored 'General case' 0 C--N 1.343 0.323 0 C-N-CA 119.937 -0.705 . . . . 36.780000000000001 110.773 177.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 49.8 tp -66.95 -49.11 66.5 Favored 'General case' 0 C--O 1.237 0.397 0 O-C-N 121.898 -0.501 . . . . 27.91 111.135 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.25 -35.91 31.51 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.495 0 CA-C-O 121.144 0.497 . . . . 42.030000000000001 111.96 176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -78.63 -13.2 59.94 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 112.407 0.521 . . . . 36.369999999999997 112.407 -176.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.54 122.12 84.62 Favored Pre-proline 0 C--N 1.317 -0.842 0 N-CA-C 109.12 -0.696 . . . . 66.980000000000004 109.12 -178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -64.56 -22.25 65.14 Favored 'Trans proline' 0 C--O 1.239 0.557 0 CA-C-N 119.157 0.735 . . . . 54.149999999999999 113.802 -173.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' THR . . . . . . . . . . . . . 84.4 m -89.6 -52.09 5.19 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 118.594 0.634 . . . . 79.659999999999997 111.768 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LEU . . . . . . . . . . . . . 23.9 mt -86.11 -28.64 23.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 113.26 0.837 . . . . 70.239999999999995 113.26 -176.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . -58.06 -50.25 67.81 Favored Glycine 0 N--CA 1.445 -0.706 0 N-CA-C 116.054 1.182 . . . . 43.82 116.054 -174.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -66.92 -24.84 45.52 Favored 'Trans proline' 0 C--O 1.241 0.652 0 N-CA-C 114.79 1.035 . . . . 64.670000000000002 114.79 -163.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -76.73 -16.74 59.42 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.839 0.745 . . . . 115.59999999999999 112.68 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ILE . . . . . . . . . . . . . 89.2 mt -86.47 112.04 22.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.602 -0.888 . . . . 54.200000000000003 108.602 -176.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' THR . . . . . . . . . . . . . 69.1 p -82.6 162.51 55.49 Favored Pre-proline 0 C--O 1.239 0.508 0 CA-C-N 116.265 -0.425 . . . . 34.460000000000001 111.032 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -55.18 -37.5 94.18 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 120.382 0.721 . . . . 30.920000000000002 113.819 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -58.41 -39.78 80.66 Favored 'General case' 0 CA--C 1.512 -0.481 0 C-N-CA 118.671 -1.212 . . . . 33.609999999999999 110.646 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' TRP . . . . . . . . . . . . . 41.2 m95 -72.87 -37.17 67.43 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.189 -0.604 . . . . 22.949999999999999 111.933 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' VAL . . . . . . . . . . . . . 74.0 t -57.44 -44.63 84.93 Favored 'Isoleucine or valine' 0 C--O 1.239 0.512 0 C-N-CA 120.008 -0.677 . . . . 29.329999999999998 109.738 173.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ARG . . . . . . . . . . . . . 1.8 tpp85 -60.36 -49.06 79.11 Favored 'General case' 0 C--O 1.242 0.685 0 O-C-N 121.783 -0.573 . . . . 115.98 110.676 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' THR . . . . . . . . . . . . . 54.3 m -56.43 -50.47 71.56 Favored 'General case' 0 C--O 1.246 0.906 0 CA-C-O 121.288 0.566 . . . . 21.649999999999999 111.763 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LEU . . . . . . . . . . . . . 80.1 mt -67.65 -39.33 84.6 Favored 'General case' 0 C--O 1.24 0.555 0 O-C-N 121.795 -0.566 . . . . 20.32 111.716 -176.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' SER . . . . . . . . . . . . . 81.4 p -57.12 -24.32 53.33 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 112.669 0.618 . . . . 30.0 112.669 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ARG . . . . . . . . . . . . . 26.5 mtm180 -89.21 5.53 44.35 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 118.666 -0.683 . . . . 37.659999999999997 112.394 -175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ILE . . . . . . . . . . . . . 96.2 mt -89.56 116.18 30.54 Favored 'Isoleucine or valine' 0 C--O 1.243 0.736 0 CA-C-N 119.281 0.946 . . . . 21.469999999999999 110.264 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLU . . . . . 0.431 ' OE2' ' OE1' ' B' ' 73' ' ' GLU . 15.1 tt0 -162.62 148.82 12.69 Favored 'General case' 0 C--O 1.233 0.194 0 N-CA-C 107.903 -1.147 . . . . 59.670000000000002 107.903 -173.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 15.9 tp -122.51 111.06 16.36 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 106.284 -1.747 . . . . 28.059999999999999 106.284 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ARG . . . . . . . . . . . . . 6.1 mtp85 46.57 47.12 14.58 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.148 0.975 . . . . 34.329999999999998 111.429 -178.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLY . . . . . . . . . . . . . . . 83.62 -5.82 76.44 Favored Glycine 0 N--CA 1.443 -0.88 0 CA-C-N 114.988 -1.006 . . . . 38.469999999999999 114.729 175.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' LYS . . . . . . . . . . . . . 4.9 mmtp -97.44 132.72 42.87 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 118.678 1.239 . . . . 102.59 109.385 -177.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ARG . . . . . . . . . . . . . 3.5 mtt180 -118.51 151.15 49.31 Favored Pre-proline 0 C--N 1.353 0.755 0 C-N-CA 123.741 0.816 . . . . 90.480000000000004 111.358 -179.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -44.34 144.81 2.76 Favored 'Trans proline' 0 C--N 1.364 1.393 0 N-CA-C 109.881 -0.853 . . . . 21.93 109.881 168.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ARG . . . . . 1.155 ' NH2' ' O ' ' B' ' 201' ' ' HOH . 7.8 mmm180 -93.03 -48.46 6.49 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 112.859 0.689 . . . . 106.17 112.859 -164.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . 10.0 p30 -123.06 169.23 11.41 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 119.124 -1.03 . . . . 40.880000000000003 112.758 -168.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -57.79 -37.72 74.23 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 118.401 -1.32 . . . . 45.100000000000001 111.457 -173.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' GLN . . . . . 0.416 ' OE1' ' NZ ' ' C' ' 125' ' ' LYS . 13.8 tt0 -61.83 -40.09 94.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.455 -0.498 . . . . 87.819999999999993 112.312 177.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 55.6 m-20 -63.31 -41.64 98.95 Favored 'General case' 0 CA--C 1.508 -0.655 0 N-CA-C 109.139 -0.689 . . . . 28.219999999999999 109.139 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TRP . . . . . . . . . . . . . 84.3 m95 -66.86 -40.72 87.95 Favored 'General case' 0 C--O 1.25 1.103 0 O-C-N 122.06 -0.4 . . . . 18.890000000000001 111.932 178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' TYR . . . . . . . . . . . . . 9.0 t80 -65.03 -38.72 91.81 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 119.027 -1.069 . . . . 35.289999999999999 110.761 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -55.56 -44.48 76.85 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 116.343 -0.389 . . . . 23.379999999999999 111.723 177.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' ILE . . . . . . . . . . . . . 62.7 mt -67.9 -47.67 78.3 Favored 'Isoleucine or valine' 0 C--O 1.249 1.042 0 C-N-CA 123.837 0.855 . . . . 20.739999999999998 110.881 178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 34.7 t80 -56.72 -49.28 75.63 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-N 115.932 -0.576 . . . . 28.620000000000001 110.664 -177.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' LEU . . . . . . . . . . . . . 91.6 mt -58.71 -44.32 90.34 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 118.024 -1.471 . . . . 25.100000000000001 111.834 -177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' HIS . . . . . . . . . . . . . 12.7 t-160 -68.67 -47.25 66.98 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 119.4 -0.92 . . . . 19.260000000000002 110.313 -178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' LEU . . . . . . . . . . . . . 13.0 mt -62.06 -38.57 89.28 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.606 -0.838 . . . . 34.159999999999997 112.508 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' LYS . . . . . . . . . . . . . 34.5 ttpt -61.46 -37.37 83.34 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 120.565 -1.335 . . . . 56.869999999999997 111.361 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ARG . . . . . . . . . . . . . 56.7 ttm-85 -63.51 -42.28 98.5 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.503 -0.879 . . . . 32.799999999999997 109.846 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ILE . . . . . . . . . . . . . 87.6 mt -69.08 -43.75 81.56 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.325 0 O-C-N 123.554 0.534 . . . . 31.739999999999998 110.89 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' LEU . . . . . . . . . . . . . 92.9 mt -93.37 -2.73 54.43 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.902 1.075 . . . . 44.909999999999997 113.902 -170.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 68.3 m . . . . . 0 C--N 1.324 -0.503 0 N-CA-C 106.398 -1.704 . . . . 80.120000000000005 106.398 171.206 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.508 0 N-CA-C 113.531 0.172 . . . . 80.370000000000005 113.531 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' ALA . . . . . . . . . . . . . . . -106.58 1.4 25.26 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.806 1.039 . . . . 59.5 113.806 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.25 157.7 47.43 Favored Pre-proline 0 C--N 1.3 -1.566 0 CA-C-N 118.538 0.608 . . . . 37.670000000000002 109.907 175.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -52.17 143.46 41.92 Favored 'Trans proline' 0 C--N 1.328 -0.525 0 N-CA-C 109.527 -0.99 . . . . 36.590000000000003 109.527 167.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' LYS . . . . . . . . . . . . . 6.5 tptm -62.05 -38.25 88.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.483 -0.887 . . . . 109.91 112.204 -173.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.55 -30.42 76.42 Favored Glycine 0 N--CA 1.449 -0.494 0 C-N-CA 118.968 -1.587 . . . . 33.170000000000002 112.44 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' LEU . . . . . . . . . . . . . 15.7 tp -74.65 -43.21 56.45 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.409 -0.465 . . . . 29.73 111.357 177.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' SER . . . . . . . . . . . . . 5.3 m -56.18 -39.03 71.77 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 120.677 0.275 . . . . 49.539999999999999 110.595 171.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -62.57 -44.81 95.41 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.202 -0.599 . . . . 41.25 110.538 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LEU . . . . . . . . . . . . . 42.8 tp -61.77 -43.05 99.61 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.208 -0.451 . . . . 32.920000000000002 110.617 -178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' ILE . . . . . . . . . . . . . 19.9 mm -68.16 -32.69 57.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 C-N-CA 120.755 -0.378 . . . . 66.390000000000001 110.322 -177.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' ALA . . . . . . . . . . . . . . . -79.06 -11.47 59.99 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-O 118.844 -0.598 . . . . 43.859999999999999 112.287 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -65.7 124.84 88.51 Favored Pre-proline 0 C--O 1.24 0.585 0 C-N-CA 118.859 -1.136 . . . . 46.490000000000002 108.8 179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.73 -18.24 28.78 Favored 'Trans proline' 0 C--O 1.237 0.464 0 CA-C-N 119.371 0.811 . . . . 49.350000000000001 113.893 -171.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' THR . . . . . . . . . . . . . 24.0 p -97.38 -39.65 9.09 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 113.495 0.924 . . . . 58.109999999999999 113.495 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' LEU . . . . . . . . . . . . . 45.9 mt -89.07 -29.07 19.69 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 112.708 0.633 . . . . 49.950000000000003 112.708 -174.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.97 -49.12 56.61 Favored Glycine 0 N--CA 1.445 -0.743 0 N-CA-C 114.617 0.607 . . . . 40.359999999999999 114.617 -172.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -59.28 -27.6 85.44 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 114.035 0.744 . . . . 48.240000000000002 114.035 -167.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' GLN . . . . . . . . . . . . . 26.3 pt20 -73.74 -18.55 60.97 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 119.741 -0.784 . . . . 97.510000000000005 112.4 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' ILE . . . . . . . . . . . . . 46.6 mt -85.47 114.41 25.37 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.15 0 N-CA-C 108.98 -0.748 . . . . 46.600000000000001 108.98 -171.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' THR . . . . . . . . . . . . . 42.8 p -78.72 163.52 60.48 Favored Pre-proline 0 C--N 1.309 -1.184 0 CA-C-O 121.071 0.462 . . . . 36.25 109.865 -173.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -58.85 -36.33 97.15 Favored 'Trans proline' 0 C--O 1.235 0.355 0 C-N-CA 119.91 0.406 . . . . 34.780000000000001 113.036 177.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -59.23 -42.42 90.98 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 117.827 0.285 . . . . 43.530000000000001 110.548 176.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' TRP . . . . . 0.402 ' CZ2' HD22 ' A' ' 106' ' ' LEU . 47.6 m95 -65.33 -39.36 92.31 Favored 'General case' 0 C--O 1.245 0.84 0 O-C-N 120.968 -1.082 . . . . 23.879999999999999 113.149 177.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' VAL . . . . . . . . . . . . . 69.3 t -57.59 -46.7 86.32 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.226 0 CA-C-O 121.538 0.685 . . . . 29.850000000000001 109.362 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' ARG . . . . . 0.503 ' HD3' ' NH2' ' C' ' 103' ' ' ARG . 3.0 ttt180 -59.9 -48.74 80.47 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.997 -0.681 . . . . 95.689999999999998 111.442 178.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' THR . . . . . . . . . . . . . 31.0 m -56.06 -50.8 69.96 Favored 'General case' 0 C--N 1.319 -0.737 0 O-C-N 121.479 -0.763 . . . . 19.420000000000002 109.939 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LEU . . . . . . . . . . . . . 78.7 mt -63.86 -40.5 96.69 Favored 'General case' 0 CA--C 1.511 -0.527 0 O-C-N 121.847 -0.533 . . . . 19.699999999999999 110.091 -175.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' SER . . . . . . . . . . . . . 59.8 p -61.04 -18.82 59.88 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 120.017 -0.673 . . . . 26.710000000000001 112.499 -175.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ARG . . . . . 0.503 ' NH2' ' HD3' ' C' ' 99' ' ' ARG . 53.1 mtt85 -89.06 2.25 54.35 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-O 118.224 -0.893 . . . . 87.329999999999998 112.247 -178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ILE . . . . . . . . . . . . . 96.6 mt -89.14 111.39 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 118.953 0.797 . . . . 23.789999999999999 108.987 -176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLU . . . . . . . . . . . . . 2.8 pp20? -159.74 153.6 23.04 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.754 0.788 . . . . 58.240000000000002 109.839 175.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' LEU . . . . . . . . . . . . . 11.8 tp -131.34 106.01 8.0 Favored 'General case' 0 C--O 1.242 0.701 0 N-CA-C 105.153 -2.166 . . . . 39.590000000000003 105.153 179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' ARG . . . . . 0.837 ' NH2' ' O3 ' ' C' ' 201' ' ' SO4 . 88.1 mtm-85 47.2 39.97 9.35 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-O 121.471 0.653 . . . . 57.060000000000002 112.414 -174.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' GLY . . . . . . . . . . . . . . . 82.51 -9.85 57.32 Favored Glycine 0 C--O 1.24 0.504 0 N-CA-C 115.606 1.002 . . . . 44.450000000000003 115.606 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' LYS . . . . . . . . . . . . . 5.4 mtmm -78.11 134.81 37.64 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-N 118.841 1.32 . . . . 97.319999999999993 108.649 174.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' ARG . . . . . 0.522 ' HG2' HH11 ' C' ' 110' ' ' ARG . 11.6 mtt-85 -137.41 161.96 57.75 Favored Pre-proline 0 CA--C 1.548 0.896 0 N-CA-C 107.463 -1.31 . . . . 104.28 107.463 -172.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_exo -48.7 135.82 27.68 Favored 'Trans proline' 0 C--N 1.309 -1.528 0 O-C-N 124.25 1.658 . . . . 33.079999999999998 107.903 166.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' ARG . . . . . . . . . . . . . 17.7 mtt180 -91.4 -34.51 14.83 Favored 'General case' 0 C--N 1.317 -0.813 0 C-N-CA 118.337 -1.345 . . . . 129.13999999999999 113.431 -162.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 52.7 p30 -133.65 176.09 8.86 Favored 'General case' 0 C--O 1.243 0.745 0 CA-C-O 122.048 0.928 . . . . 43.18 109.742 -176.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' LYS . . . . . . . . . . . . . 23.2 pttt -63.95 -33.71 76.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.386 -0.825 . . . . 61.619999999999997 111.393 -174.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -64.92 -41.52 95.48 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 119.78 -0.768 . . . . 57.729999999999997 111.302 175.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -60.73 -43.47 97.84 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.383 -0.927 . . . . 41.07 109.845 178.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -65.33 -41.67 93.71 Favored 'General case' 0 C--O 1.247 0.942 0 C-N-CA 119.7 -0.8 . . . . 27.539999999999999 112.013 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -65.39 -39.67 92.5 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 109.689 -0.485 . . . . 43.920000000000002 109.689 -178.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' GLU . . . . . . . . . . . . . 64.5 tt0 -59.49 -47.39 85.67 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 120.67 -0.412 . . . . 26.260000000000002 111.869 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' ILE . . . . . . . . . . . . . 10.2 tp -70.93 -38.95 74.52 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 120.566 -0.454 . . . . 30.579999999999998 110.965 178.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -53.37 -49.23 67.63 Favored 'General case' 0 C--O 1.243 0.757 0 O-C-N 121.46 -0.775 . . . . 29.390000000000001 111.532 175.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' LEU . . . . . . . . . . . . . 95.7 mt -61.93 -41.24 97.72 Favored 'General case' 0 C--O 1.238 0.45 0 O-C-N 121.014 -1.053 . . . . 23.219999999999999 110.704 -177.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' HIS . . . . . . . . . . . . . 12.5 t-160 -71.34 -44.09 65.74 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 118.696 -1.202 . . . . 18.559999999999999 110.412 -176.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' LEU . . . . . . . . . . . . . 72.4 mt -63.11 -39.26 94.18 Favored 'General case' 0 C--O 1.242 0.664 0 O-C-N 121.731 -0.605 . . . . 24.489999999999998 111.049 178.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' LYS . . . . . 0.416 ' NZ ' ' OE1' ' B' ' 115' ' ' GLN . 16.0 tttt -58.21 -34.74 70.73 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.345 0.593 . . . . 116.33 111.281 -177.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -71.79 -28.75 63.82 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.519 -0.473 . . . . 30.02 111.185 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' ILE . . . . . . . . . . . . . 92.5 mt -81.84 -41.19 18.24 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 118.068 0.394 . . . . 29.210000000000001 111.269 176.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' LEU . . . . . . . . . . . . . 88.6 mt -104.08 -24.88 13.15 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 115.884 1.809 . . . . 50.960000000000001 115.884 -168.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' SER . . . . . . . . . . . . . 43.9 p . . . . . 0 CA--C 1.538 0.508 0 CA-C-N 120.306 1.412 . . . . 125.23999999999999 108.269 -178.22 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.489 0 CA-C-O 120.205 -0.22 . . . . 88.010000000000005 113.384 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' ALA . . . . . . . . . . . . . . . -148.59 149.18 31.1 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 109.508 -0.553 . . . . 67.359999999999999 109.508 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 tp -106.94 112.13 63.43 Favored Pre-proline 0 C--O 1.241 0.651 0 N-CA-C 109.16 -0.681 . . . . 44.409999999999997 109.16 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' PRO . . . . . 0.436 ' HB3' ' HD3' ' D' ' 110' ' ' ARG . 32.9 Cg_exo -67.39 148.27 79.16 Favored 'Trans proline' 0 C--N 1.331 -0.382 0 C-N-CA 120.875 1.05 . . . . 36.780000000000001 111.759 177.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' LYS . . . . . 0.427 ' HA ' ' HD2' ' D' ' 78' ' ' LYS . 1.1 tptt -69.12 -41.56 77.22 Favored 'General case' 0 C--O 1.231 0.102 0 C-N-CA 119.537 -0.865 . . . . 77.310000000000002 111.676 -171.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' GLY . . . . . . . . . . . . . . . -62.68 -36.35 93.16 Favored Glycine 0 CA--C 1.522 0.529 0 C-N-CA 119.719 -1.229 . . . . 32.619999999999997 114.327 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' LEU . . . . . . . . . . . . . 33.5 tp -66.35 -45.03 81.58 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 121.912 -0.758 . . . . 33.090000000000003 110.656 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' SER . . . . . . . . . . . . . 36.5 t -53.76 -40.51 66.27 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 120.917 -0.313 . . . . 44.409999999999997 111.362 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' ASP . . . . . . . . . . . . . 93.6 m-20 -63.25 -42.84 99.22 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.631 -0.427 . . . . 47.719999999999999 111.454 176.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LEU . . . . . . . . . . . . . 23.7 tp -64.35 -45.61 87.05 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 121.97 -0.456 . . . . 34.659999999999997 111.412 179.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ILE . . . . . . . . . . . . . 40.6 mt -56.58 -39.68 64.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 C-N-CA 120.682 -0.407 . . . . 43.770000000000003 111.093 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' ALA . . . . . . . . . . . . . . . -75.74 -16.78 60.09 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.287 1.035 . . . . 47.020000000000003 113.61 178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -57.42 121.28 46.81 Favored Pre-proline 0 C--N 1.323 -0.565 0 N-CA-C 108.256 -1.016 . . . . 46.780000000000001 108.256 176.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -68.15 -18.7 45.41 Favored 'Trans proline' 0 N--CA 1.475 0.432 0 CA-C-N 119.664 0.916 . . . . 55.649999999999999 114.327 -172.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' THR . . . . . . . . . . . . . 73.3 p -100.5 -41.77 6.85 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.093 0.861 . . . . 69.140000000000001 112.631 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' LEU . . . . . 0.427 ' O ' ' HG2' ' D' ' 92' ' ' GLN . 26.1 mt -88.07 -23.48 23.71 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 113.147 0.795 . . . . 46.109999999999999 113.147 -177.938 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLY . . . . . 0.421 ' N ' ' CD ' ' D' ' 91' ' ' PRO . . . -81.07 -34.36 26.94 Favored Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 116.556 1.382 . . . . 38.369999999999997 116.556 -167.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' PRO . . . . . 0.421 ' CD ' ' N ' ' D' ' 90' ' ' GLY . 50.9 Cg_exo -61.79 -28.04 81.29 Favored 'Trans proline' 0 C--N 1.327 -0.603 0 CA-C-N 118.951 1.375 . . . . 47.869999999999997 113.614 -173.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' GLN . . . . . 0.427 ' HG2' ' O ' ' D' ' 89' ' ' LEU . 4.3 pt20 -66.23 -22.1 66.32 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 118.722 -0.656 . . . . 67.719999999999999 112.361 -176.734 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' ILE . . . . . . . . . . . . . 2.8 mt -80.1 109.89 15.11 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.354 0 N-CA-C 108.33 -0.989 . . . . 56.640000000000001 108.33 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' THR . . . . . . . . . . . . . 70.8 p -77.29 163.04 66.93 Favored Pre-proline 0 C--N 1.312 -1.041 0 N-CA-C 109.529 -0.545 . . . . 27.239999999999998 109.529 -175.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' PRO . . . . . 0.597 ' O ' ' HG3' ' D' ' 99' ' ' ARG . 61.8 Cg_exo -54.08 -38.81 87.34 Favored 'Trans proline' 0 C--N 1.318 -1.06 0 N-CA-C 113.598 0.576 . . . . 25.359999999999999 113.598 172.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -57.91 -42.09 84.04 Favored 'General case' 0 C--O 1.241 0.613 0 O-C-N 120.8 -1.188 . . . . 38.799999999999997 111.122 174.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' TRP . . . . . 0.408 ' CZ2' ' HA ' ' D' ' 125' ' ' LYS . 59.3 m95 -68.49 -35.65 77.82 Favored 'General case' 0 C--O 1.239 0.509 0 O-C-N 121.269 -0.894 . . . . 24.850000000000001 112.416 178.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.72 -51.58 42.44 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 C-N-CA 119.43 -0.908 . . . . 27.890000000000001 109.934 172.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' ARG . . . . . 0.597 ' HG3' ' O ' ' D' ' 95' ' ' PRO . 41.4 mtp180 -61.27 -45.0 96.29 Favored 'General case' 0 C--O 1.244 0.781 0 C-N-CA 119.988 -0.685 . . . . 52.07 111.884 -177.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' THR . . . . . . . . . . . . . 45.2 m -62.13 -50.79 70.49 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.303 0.573 . . . . 21.899999999999999 110.838 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' LEU . . . . . . . . . . . . . 91.8 mt -66.82 -36.1 81.58 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.392 -0.818 . . . . 23.23 110.995 -175.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' SER . . . . . . . . . . . . . 39.2 p -65.38 -14.81 61.69 Favored 'General case' 0 C--N 1.319 -0.719 0 O-C-N 121.257 -0.902 . . . . 23.91 112.343 -176.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ARG . . . . . . . . . . . . . 10.6 mmm180 -88.2 -1.27 57.92 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.179 0.807 . . . . 53.57 113.179 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' ILE . . . . . . . . . . . . . 78.3 mt -83.97 112.75 21.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 N-CA-C 108.99 -0.744 . . . . 27.649999999999999 108.99 -175.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -160.74 151.52 18.52 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 108.674 -0.861 . . . . 56.100000000000001 108.674 175.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' LEU . . . . . . . . . . . . . 27.1 tp -122.71 113.6 19.43 Favored 'General case' 0 C--O 1.241 0.654 0 N-CA-C 105.916 -1.883 . . . . 28.41 105.916 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' ARG . . . . . . . . . . . . . 79.1 mtm-85 52.04 39.05 25.6 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.369 0.604 . . . . 35.960000000000001 110.267 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' GLY . . . . . . . . . . . . . . . 85.64 -3.07 87.66 Favored Glycine 0 N--CA 1.449 -0.446 0 CA-C-O 118.735 -1.036 . . . . 42.130000000000003 114.756 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' LYS . . . . . . . . . . . . . 3.4 mmmm -107.98 146.74 32.05 Favored 'General case' 0 C--O 1.239 0.505 0 C-N-CA 124.605 1.162 . . . . 88.689999999999998 109.692 -176.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ARG . . . . . 0.436 ' HD3' ' HB3' ' D' ' 77' ' ' PRO . 29.3 mtt-85 -127.12 164.38 35.81 Favored Pre-proline 0 C--O 1.244 0.782 0 CA-C-N 115.671 -0.695 . . . . 102.56999999999999 112.773 -169.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -44.83 137.96 8.79 Favored 'Trans proline' 0 CA--C 1.514 -0.511 0 N-CA-C 107.937 -1.601 . . . . 34.060000000000002 107.937 167.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' ARG . . . . . . . . . . . . . 55.4 mmt-85 -84.55 -37.64 20.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 119.453 -0.899 . . . . 96.150000000000006 112.201 -158.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 13.0 p30 -142.66 178.04 7.9 Favored 'General case' 0 C--O 1.235 0.336 0 O-C-N 121.68 -0.637 . . . . 44.909999999999997 109.646 -170.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 mtmm -53.95 -42.56 69.02 Favored 'General case' 0 C--O 1.242 0.691 0 CA-C-N 115.662 -0.699 . . . . 110.34 111.531 -176.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' GLN . . . . . . . . . . . . . 49.5 tt0 -65.5 -41.46 93.19 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 116.477 -0.329 . . . . 57.18 110.574 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' ASP . . . . . . . . . . . . . 80.2 m-20 -62.63 -42.14 99.43 Favored 'General case' 0 C--O 1.245 0.843 0 CA-C-O 121.897 0.856 . . . . 35.689999999999998 110.646 177.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' TRP . . . . . . . . . . . . . 84.1 m95 -67.26 -41.28 85.81 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 121.005 -1.059 . . . . 25.41 111.381 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' TYR . . . . . 0.419 ' OH ' ' OE1' ' A' ' 115' ' ' GLN . 9.9 t80 -62.55 -42.22 99.4 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 120.444 -0.503 . . . . 44.979999999999997 110.924 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' GLU . . . . . . . . . . . . . 60.2 tt0 -58.84 -45.32 90.33 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 116.471 -0.331 . . . . 23.300000000000001 111.673 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' ILE . . . . . . . . . . . . . 44.0 mt -64.15 -49.98 78.89 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.62 0 C-N-CA 124.553 1.141 . . . . 40.740000000000002 111.34 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -53.2 -47.36 68.98 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-N 116.65 -0.25 . . . . 31.010000000000002 111.526 179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' LEU . . . . . . . . . . . . . 93.2 mt -61.57 -43.98 97.86 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 119.862 -0.735 . . . . 26.510000000000002 111.017 -176.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -69.25 -44.77 71.26 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 119.821 -0.752 . . . . 19.899999999999999 110.956 -178.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' LEU . . . . . . . . . . . . . 63.4 mt -65.83 -34.82 79.03 Favored 'General case' 0 C--O 1.242 0.707 0 C-N-CA 119.363 -0.935 . . . . 26.109999999999999 111.614 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' LYS . . . . . 0.408 ' HA ' ' CZ2' ' D' ' 97' ' ' TRP . 12.3 tttt -63.3 -34.71 78.28 Favored 'General case' 0 CA--C 1.513 -0.461 0 O-C-N 121.432 -0.793 . . . . 96.340000000000003 109.922 -179.901 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' ARG . . . . . . . . . . . . . 48.7 ttm-85 -67.96 -34.94 77.52 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.118 -1.033 . . . . 27.300000000000001 111.188 177.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' ILE . . . . . . . . . . . . . 98.3 mt -74.8 -44.18 45.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 C-N-CA 119.865 -0.734 . . . . 27.600000000000001 110.778 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' LEU . . . . . . . . . . . . . 84.3 mt -96.64 -125.14 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 N-CA-C 106.477 -1.675 . . . . 55.399999999999999 106.477 -174.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' SER . . . . . . . . . . . . . 14.9 t . . . . . 0 C--N 1.316 -0.89 0 C-N-CA 116.635 -2.026 . . . . 192.41 111.835 178.65 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 74' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.243 0 N-CA-C 112.195 -0.362 . . . . 82.420000000000002 112.195 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.52 154.01 19.94 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.801 0.81 . . . . 54.770000000000003 111.03 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 76' ' ' LEU . . . . . . . . . . . . . 53.7 mt -65.48 139.15 97.16 Favored Pre-proline 0 C--N 1.322 -0.612 0 C-N-CA 119.292 -0.963 . . . . 42.740000000000002 109.333 175.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 77' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.33 139.63 86.88 Favored 'Trans proline' 0 C--O 1.241 0.643 0 N-CA-C 110.4 -0.654 . . . . 29.219999999999999 110.4 175.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 78' ' ' LYS . . . . . . . . . . . . . 18.1 tptm -50.42 -50.55 51.63 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.897 0.703 . . . . 47.75 112.897 177.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 79' ' ' GLY . . . . . . . . . . . . . . . -63.35 -32.06 82.85 Favored Glycine 0 C--N 1.346 1.1 0 C-N-CA 119.548 -1.311 . . . . 23.149999999999999 111.792 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 80' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.59 -34.33 62.84 Favored 'General case' 0 N--CA 1.444 -0.733 0 O-C-N 122.021 -0.693 . . . . 25.690000000000001 111.186 177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 81' ' ' SER . . . . . 0.479 ' OG ' ' HG2' ' D' ' 99' ' ' ARG . 45.2 m -63.83 -33.31 75.39 Favored 'General case' 0 C--O 1.242 0.673 0 C-N-CA 120.154 -0.619 . . . . 31.5 111.41 171.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 82' ' ' ASP . . . . . . . . . . . . . 97.2 m-20 -61.16 -42.24 98.21 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.872 -0.731 . . . . 35.780000000000001 109.783 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 83' ' ' LEU . . . . . . . . . . . . . 44.9 tp -65.87 -45.08 83.42 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-O 120.979 0.418 . . . . 43.18 110.155 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 84' ' ' ILE . . . . . . . . . . . . . 84.7 mt -58.27 -40.15 76.61 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.213 0 O-C-N 121.59 -0.694 . . . . 28.309999999999999 111.262 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.81 -3.48 56.77 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 113.923 1.082 . . . . 35.409999999999997 113.923 -176.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 86' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -69.59 124.81 91.32 Favored Pre-proline 0 C--N 1.313 -1.021 0 CA-C-N 119.177 0.899 . . . . 47.259999999999998 109.316 179.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 87' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -65.33 -25.87 56.47 Favored 'Trans proline' 0 N--CA 1.475 0.423 0 CA-C-N 119.847 0.981 . . . . 60.590000000000003 114.229 -172.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 88' ' ' THR . . . . . . . . . . . . . 51.7 p -94.75 -41.82 9.06 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 119.257 0.935 . . . . 83.0 113.293 178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 89' ' ' LEU . . . . . 0.404 HD21 HD21 ' F' ' 89' ' ' LEU . 44.2 mt -86.75 -32.13 20.57 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 114.462 1.282 . . . . 56.270000000000003 114.462 -177.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 90' ' ' GLY . . . . . . . . . . . . . . . -56.08 -42.09 86.73 Favored Glycine 0 N--CA 1.439 -1.157 0 N-CA-C 116.21 1.244 . . . . 46.869999999999997 116.21 -174.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 91' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -55.97 -25.04 51.47 Favored 'Trans proline' 0 C--N 1.352 0.729 0 CA-C-N 118.032 0.916 . . . . 80.010000000000005 114.051 -176.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 92' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -76.59 -18.69 58.5 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.049 0.759 . . . . 130.97 113.049 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 93' ' ' ILE . . . . . . . . . . . . . 3.3 mm -95.88 88.16 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 N-CA-C 106.816 -1.55 . . . . 67.060000000000002 106.816 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 94' ' ' THR . . . . . . . . . . . . . 71.4 p -60.77 161.05 16.29 Favored Pre-proline 0 C--O 1.237 0.419 0 CA-C-N 115.793 -0.64 . . . . 38.479999999999997 110.206 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 95' ' ' PRO . . . . . . . . . . . . . 91.4 Cg_exo -53.16 -34.67 69.98 Favored 'Trans proline' 0 N--CA 1.478 0.6 0 N-CA-C 114.248 0.826 . . . . 38.039999999999999 114.248 173.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 96' ' ' ASP . . . . . . . . . . . . . 64.3 m-20 -64.46 -40.92 96.62 Favored 'General case' 0 CA--C 1.502 -0.897 0 C-N-CA 119.252 -0.979 . . . . 44.840000000000003 111.72 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 97' ' ' TRP . . . . . . . . . . . . . 35.6 m95 -69.18 -33.02 72.72 Favored 'General case' 0 CA--C 1.512 -0.503 0 C-N-CA 119.681 -0.808 . . . . 30.390000000000001 110.596 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 98' ' ' VAL . . . . . . . . . . . . . 41.6 t -60.97 -44.9 99.07 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.354 0 C-N-CA 119.342 -0.943 . . . . 40.390000000000001 110.27 175.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 99' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -63.88 -44.9 91.67 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.457 -0.897 . . . . 84.379999999999995 111.396 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 100' ' ' THR . . . . . . . . . . . . . 19.2 m -62.78 -44.38 96.33 Favored 'General case' 0 C--O 1.24 0.596 0 C-N-CA 119.331 -0.948 . . . . 27.640000000000001 110.698 -177.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' LEU . . . . . . . . . . . . . 84.1 mt -66.53 -40.38 89.11 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 116.406 -0.361 . . . . 23.469999999999999 110.595 -177.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 102' ' ' SER . . . . . . . . . . . . . 51.9 p -66.85 -15.26 63.5 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 120.082 -0.647 . . . . 36.25 112.092 -171.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 103' ' ' ARG . . . . . . . . . . . . . 29.4 mtm180 -86.35 1.41 51.2 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 113.499 0.926 . . . . 138.0 113.499 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 104' ' ' ILE . . . . . . . . . . . . . 85.1 mt -89.88 109.84 21.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 109.048 -0.723 . . . . 31.559999999999999 109.048 -175.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 105' ' ' GLU . . . . . 0.48 ' OE1' ' O ' ' E' ' 301' ' ' HOH . 1.1 pp20? -157.1 152.49 26.47 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.585 -0.894 . . . . 87.299999999999997 108.585 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 106' ' ' LEU . . . . . . . . . . . . . 4.6 tp -132.27 104.66 6.87 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 108.81 -0.811 . . . . 45.609999999999999 108.81 178.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 107' ' ' ARG . . . . . . . . . . . . . 15.9 mmm-85 43.36 44.6 4.85 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 112.638 0.607 . . . . 88.659999999999997 112.638 179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 108' ' ' GLY . . . . . . . . . . . . . . . 97.11 -22.45 40.68 Favored Glycine 0 N--CA 1.442 -0.956 0 CA-C-O 119.303 -0.721 . . . . 53.100000000000001 114.789 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 109' ' ' LYS . . . . . . . . . . . . . 17.3 mttp -78.43 148.99 33.36 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 118.145 0.973 . . . . 50.439999999999998 111.095 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 110' ' ' ARG . . . . . . . . . . . . . 32.4 ptt85 -161.56 166.26 15.08 Favored Pre-proline 0 C--O 1.244 0.793 0 N-CA-C 107.923 -1.14 . . . . 61.869999999999997 107.923 -171.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 111' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -64.56 153.91 74.76 Favored 'Trans proline' 0 C--N 1.329 -0.478 0 N-CA-C 109.426 -1.029 . . . . 25.210000000000001 109.426 167.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 112' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -119.45 -40.23 2.81 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 114.358 1.244 . . . . 56.270000000000003 114.358 -169.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 113' ' ' ASP . . . . . . . . . . . . . 36.2 p30 -121.08 173.86 7.01 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 119.469 1.031 . . . . 43.140000000000001 111.836 -178.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 114' ' ' LYS . . . . . . . . . . . . . 52.7 pttt -64.45 -29.93 70.97 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 117.686 -1.606 . . . . 40.329999999999998 111.007 -171.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 115' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -65.27 -43.35 91.52 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.001 -0.68 . . . . 90.239999999999995 111.376 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 116' ' ' ASP . . . . . . . . . . . . . 83.0 m-20 -53.67 -48.89 69.04 Favored 'General case' 0 C--O 1.245 0.846 0 CA-C-O 121.502 0.668 . . . . 30.059999999999999 110.401 176.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 117' ' ' TRP . . . . . . . . . . . . . 89.0 m95 -66.72 -41.12 88.46 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.898 -0.592 . . . . 28.52 111.121 -175.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 118' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -71.25 -35.4 71.41 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 120.146 -0.622 . . . . 56.640000000000001 111.075 -176.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 119' ' ' GLU . . . . . . . . . . . . . 68.6 tt0 -59.01 -45.86 89.61 Favored 'General case' 0 C--O 1.24 0.568 0 CA-C-O 120.912 0.387 . . . . 25.260000000000002 110.454 175.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 120' ' ' ILE . . . . . . . . . . . . . 52.3 mt -66.33 -50.01 71.23 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 O-C-N 122.1 -0.375 . . . . 25.32 111.024 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 121' ' ' TYR . . . . . . . . . . . . . 45.4 t80 -48.23 -49.3 33.66 Favored 'General case' 0 C--N 1.349 0.547 0 N-CA-C 112.687 0.625 . . . . 43.030000000000001 112.687 177.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 122' ' ' LEU . . . . . . . . . . . . . 73.7 mt -62.57 -39.95 95.3 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 119.02 -1.072 . . . . 30.710000000000001 111.08 -175.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 123' ' ' HIS . . . . . . . . . . . . . 7.9 t-160 -72.77 -41.68 64.78 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.589 0.709 . . . . 27.899999999999999 109.798 -176.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 124' ' ' LEU . . . . . . . . . . . . . 16.2 mt -69.68 -41.33 75.6 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 119.953 -0.699 . . . . 53.770000000000003 111.64 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 125' ' ' LYS . . . . . . . . . . . . . 22.6 tttm -55.61 -34.68 65.09 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 119.412 -0.915 . . . . 110.70999999999999 110.562 179.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 126' ' ' ARG . . . . . . . . . . . . . 41.4 ttm-85 -67.21 -29.03 68.58 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 120.516 -0.474 . . . . 49.219999999999999 110.303 -178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 127' ' ' ILE . . . . . . . . . . . . . 75.8 mt -92.0 -39.75 11.71 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 N-CA-C 112.032 0.382 . . . . 51.490000000000002 112.032 -172.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 128' ' ' LEU . . . . . . . . . . . . . 19.0 mt . . . . . 0 C--O 1.234 0.269 0 O-C-N 121.514 -0.741 . . . . 75.390000000000001 111.107 -179.254 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 76' ' ' LEU . . . . . 0.543 HD22 HD13 ' F' ' 80' ' ' LEU . 16.1 mt . . . . . 0 N--CA 1.463 0.215 0 CA-C-O 120.018 -0.039 . . . . 47.689999999999998 110.916 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 77' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_exo -60.08 142.37 98.24 Favored 'Trans proline' 0 N--CA 1.474 0.329 0 O-C-N 122.166 0.561 . . . . 41.759999999999998 110.751 173.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 78' ' ' LYS . . . . . 0.49 ' HD3' ' OD2' ' F' ' 82' ' ' ASP . 1.0 OUTLIER -55.03 -44.75 74.93 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 120.593 -0.443 . . . . 53.159999999999997 112.033 -177.298 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' F' F ' 79' ' ' GLY . . . . . . . . . . . . . . . -66.26 -25.52 72.39 Favored Glycine 0 C--O 1.248 0.99 0 C-N-CA 118.902 -1.618 . . . . 26.440000000000001 112.332 -175.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 80' ' ' LEU . . . . . 0.543 HD13 HD22 ' F' ' 76' ' ' LEU . 3.3 tt -75.8 -47.53 25.39 Favored 'General case' 0 C--N 1.34 0.169 0 N-CA-C 112.445 0.535 . . . . 41.630000000000003 112.445 174.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 81' ' ' SER . . . . . 0.787 ' OG ' ' O ' ' F' ' 301' ' ' HOH . 25.8 t -66.57 -22.77 66.14 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 116.154 -2.219 . . . . 53.130000000000003 110.892 175.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 82' ' ' ASP . . . . . 0.49 ' OD2' ' HD3' ' F' ' 78' ' ' LYS . 96.6 m-20 -64.19 -42.29 96.73 Favored 'General case' 0 C--O 1.241 0.654 0 C-N-CA 119.218 -0.993 . . . . 39.950000000000003 110.7 171.974 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 83' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' F' ' 93' ' ' ILE . 41.5 tp -60.26 -45.7 92.36 Favored 'General case' 0 C--N 1.345 0.386 0 C-N-CA 120.02 -0.672 . . . . 31.039999999999999 111.274 174.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 84' ' ' ILE . . . . . 0.461 HD11 HD22 ' F' ' 80' ' ' LEU . 60.5 mt -58.77 -32.4 46.71 Favored 'Isoleucine or valine' 0 C--O 1.239 0.545 0 O-C-N 122.082 -0.386 . . . . 89.819999999999993 111.583 177.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.68 -4.34 59.14 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 114.065 1.135 . . . . 33.43 114.065 -177.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 86' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -76.14 125.24 88.15 Favored Pre-proline 0 C--O 1.236 0.351 0 N-CA-C 108.896 -0.779 . . . . 42.710000000000001 108.896 -178.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 87' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -67.99 -28.2 35.63 Favored 'Trans proline' 0 C--O 1.238 0.521 0 CA-C-N 119.238 0.764 . . . . 56.009999999999998 112.62 -176.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 88' ' ' THR . . . . . . . . . . . . . 54.5 m -81.38 -53.24 6.48 Favored 'General case' 0 C--O 1.235 0.337 0 O-C-N 122.195 -0.315 . . . . 64.640000000000001 111.358 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 89' ' ' LEU . . . . . 0.404 HD21 HD21 ' E' ' 89' ' ' LEU . 20.8 mt -90.17 -22.87 21.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.705 1.002 . . . . 59.390000000000001 113.705 -173.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 90' ' ' GLY . . . . . 0.403 ' N ' ' CD ' ' F' ' 91' ' ' PRO . . . -64.6 -45.66 92.33 Favored Glycine 0 N--CA 1.444 -0.795 0 N-CA-C 115.263 0.865 . . . . 39.57 115.263 -173.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 91' ' ' PRO . . . . . 0.403 ' CD ' ' N ' ' F' ' 90' ' ' GLY . 31.6 Cg_exo -62.1 -21.07 71.8 Favored 'Trans proline' 0 N--CA 1.477 0.505 0 CA-C-N 117.942 0.871 . . . . 56.890000000000001 113.1 -173.332 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 92' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -68.05 -20.6 64.99 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 112.558 0.577 . . . . 137.38999999999999 112.558 179.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 93' ' ' ILE . . . . . 0.525 HD12 ' HG ' ' F' ' 83' ' ' LEU . 21.6 mt -100.22 105.93 18.4 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 N-CA-C 109.147 -0.686 . . . . 61.729999999999997 109.147 -163.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 94' ' ' THR . . . . . . . . . . . . . 37.1 p -74.31 162.65 72.88 Favored Pre-proline 0 C--O 1.242 0.678 0 CA-C-N 115.595 -0.729 . . . . 45.770000000000003 110.54 -178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 95' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -51.38 -37.93 62.02 Favored 'Trans proline' 0 C--O 1.24 0.583 0 O-C-N 122.082 0.517 . . . . 65.530000000000001 113.338 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 96' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -63.45 -39.95 95.83 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.316 -0.554 . . . . 54.640000000000001 110.771 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 97' ' ' TRP . . . . . . . . . . . . . 38.6 m95 -67.0 -39.43 87.13 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 120.689 -0.404 . . . . 31.530000000000001 111.696 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 98' ' ' VAL . . . . . . . . . . . . . 97.6 t -54.65 -48.91 71.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 C-N-CA 119.886 -0.726 . . . . 41.090000000000003 110.57 174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 99' ' ' ARG . . . . . . . . . . . . . 19.4 mtt180 -62.16 -44.96 95.47 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 119.884 -0.726 . . . . 87.569999999999993 111.104 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 100' ' ' THR . . . . . . . . . . . . . 18.0 m -59.48 -46.61 88.32 Favored 'General case' 0 C--O 1.241 0.62 0 O-C-N 121.773 -0.58 . . . . 30.18 111.041 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' LEU . . . . . . . . . . . . . 72.6 mt -68.65 -37.98 80.09 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 120.25 -0.58 . . . . 23.399999999999999 111.42 -176.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 102' ' ' SER . . . . . . . . . . . . . 67.6 p -62.72 -20.72 65.19 Favored 'General case' 0 C--N 1.348 0.526 0 CA-C-N 118.517 0.599 . . . . 38.840000000000003 111.695 -175.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 103' ' ' ARG . . . . . 0.604 ' HD2' ' O ' ' F' ' 103' ' ' ARG . 8.8 tmm_? -83.69 1.01 44.61 Favored 'General case' 0 C--O 1.247 0.94 0 N-CA-C 114.743 1.386 . . . . 118.22 114.743 178.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 104' ' ' ILE . . . . . . . . . . . . . 84.0 mt -85.58 106.34 15.18 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 N-CA-C 107.552 -1.277 . . . . 30.41 107.552 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 105' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -163.22 146.13 10.37 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 106.89 -1.522 . . . . 107.81 106.89 -170.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 106' ' ' LEU . . . . . . . . . . . . . 3.2 tp -138.96 92.76 2.63 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 107.586 -1.264 . . . . 64.760000000000005 107.586 -175.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 107' ' ' ARG . . . . . . . . . . . . . 19.2 mtp85 45.51 46.41 10.88 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.654 0.74 . . . . 101.66 111.049 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.39 -15.39 63.36 Favored Glycine 0 N--CA 1.445 -0.736 0 N-CA-C 115.095 0.798 . . . . 48.630000000000003 115.095 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 109' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -81.17 142.44 33.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 118.021 0.911 . . . . 83.370000000000005 109.873 172.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 110' ' ' ARG . . . . . . . . . . . . . 17.6 ptt-85 -154.35 163.82 22.88 Favored Pre-proline 0 C--O 1.248 0.989 0 N-CA-C 108.905 -0.776 . . . . 79.540000000000006 108.905 -174.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 111' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_exo -57.11 151.78 48.69 Favored 'Trans proline' 0 N--CA 1.46 -0.474 0 C-N-CA 121.517 1.478 . . . . 27.0 108.289 165.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 112' ' ' ARG . . . . . . . . . . . . . 13.5 mmt180 -119.26 -15.51 9.14 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 115.487 1.662 . . . . 67.560000000000002 115.487 -161.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 113' ' ' ASP . . . . . . . . . . . . . 6.2 p30 -151.74 176.64 11.2 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 119.297 0.953 . . . . 43.990000000000002 108.53 178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 114' ' ' LYS . . . . . . . . . . . . . 22.9 ttpt -61.16 -38.7 87.38 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 115.189 -0.914 . . . . 54.5 110.988 -173.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 115' ' ' GLN . . . . . . . . . . . . . 25.1 mp0 -65.66 -38.78 90.27 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 119.539 -0.864 . . . . 84.099999999999994 110.629 -176.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 116' ' ' ASP . . . . . . . . . . . . . 81.7 m-20 -58.6 -46.61 86.64 Favored 'General case' 0 C--O 1.246 0.916 0 CA-C-O 121.551 0.691 . . . . 34.390000000000001 110.867 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 117' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -66.99 -38.77 86.63 Favored 'General case' 0 N--CA 1.447 -0.62 0 O-C-N 121.87 -0.519 . . . . 23.960000000000001 111.253 -177.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 118' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -67.73 -38.82 84.06 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 118.713 -1.195 . . . . 52.240000000000002 111.543 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 119' ' ' GLU . . . . . . . . . . . . . 66.0 tt0 -55.9 -48.17 76.12 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-O 120.93 0.395 . . . . 29.390000000000001 110.281 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 120' ' ' ILE . . . . . . . . . . . . . 96.7 mt -64.31 -49.5 80.75 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.119 0 CA-C-O 121.399 0.619 . . . . 26.149999999999999 110.213 178.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 121' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -50.22 -50.85 48.36 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 121.645 -0.659 . . . . 35.630000000000003 111.628 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 122' ' ' LEU . . . . . . . . . . . . . 86.5 mt -62.01 -41.81 98.47 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 119.949 -0.7 . . . . 29.75 110.887 -175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 123' ' ' HIS . . . . . . . . . . . . . 8.7 t-160 -69.34 -48.12 62.36 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 119.248 -0.981 . . . . 21.210000000000001 110.323 -177.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 124' ' ' LEU . . . . . . . . . . . . . 26.7 mt -61.3 -39.06 89.05 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 120.485 -0.486 . . . . 30.539999999999999 110.939 179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 125' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -60.97 -36.33 79.13 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-O 121.473 0.654 . . . . 69.030000000000001 111.108 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 126' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -71.66 -37.07 70.84 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 122.053 -0.404 . . . . 39.960000000000001 111.108 -179.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 127' ' ' ILE . . . . . . . . . . . . . 73.7 mt -71.69 -37.46 62.97 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 CA-C-O 120.875 0.369 . . . . 51.240000000000002 110.25 179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 128' ' ' LEU . . . . . . . . . . . . . 31.3 mt . . . . . 0 C--N 1.328 -0.351 0 N-CA-C 109.633 -0.506 . . . . 52.409999999999997 109.633 -178.96 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 0.384 0 CA-C-O 119.468 -0.301 . . . . 53.329999999999998 111.436 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 76' ' ' LEU . . . . . . . . . . . . . 12.3 mt -74.8 147.48 84.18 Favored Pre-proline 0 C--O 1.235 0.306 0 C-N-CA 120.361 -0.535 . . . . 53.079999999999998 110.899 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 77' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -51.15 141.67 37.82 Favored 'Trans proline' 0 C--O 1.237 0.455 0 N-CA-C 109.777 -0.894 . . . . 43.75 109.777 167.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -55.72 -40.54 72.6 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.809 -0.632 . . . . 88.950000000000003 111.897 -174.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 79' ' ' GLY . . . . . . . . . . . . . . . -64.94 -31.05 79.64 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 119.551 -1.309 . . . . 31.100000000000001 113.039 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 80' ' ' LEU . . . . . . . . . . . . . 41.5 mt -77.2 -36.36 54.95 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 118.627 -1.229 . . . . 40.859999999999999 110.894 178.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 81' ' ' SER . . . . . . . . . . . . . 11.8 t -60.34 -39.11 85.93 Favored 'General case' 0 C--N 1.34 0.171 0 C-N-CA 119.057 -1.057 . . . . 49.310000000000002 109.724 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 82' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -66.1 -40.44 90.77 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 119.436 -0.906 . . . . 43.630000000000003 111.474 177.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 83' ' ' LEU . . . . . 0.44 HD23 ' C ' ' G' ' 83' ' ' LEU . 18.0 tp -60.18 -43.72 95.65 Favored 'General case' 0 C--N 1.347 0.481 0 CA-C-O 120.932 0.396 . . . . 32.07 110.857 -179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 84' ' ' ILE . . . . . . . . . . . . . 31.8 pt -73.54 -15.1 16.85 Favored 'Isoleucine or valine' 0 C--O 1.244 0.774 0 C-N-CA 119.245 -0.982 . . . . 34.670000000000002 112.119 -172.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.57 -2.8 44.21 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.841 0.682 . . . . 31.57 112.841 174.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 86' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -82.77 129.35 62.42 Favored Pre-proline 0 N--CA 1.452 -0.333 0 N-CA-C 109.256 -0.646 . . . . 40.100000000000001 109.256 -177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 87' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -67.22 -23.31 45.44 Favored 'Trans proline' 0 CA--C 1.498 -1.32 0 CA-C-O 118.293 -0.795 . . . . 38.109999999999999 113.799 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 88' ' ' THR . . . . . . . . . . . . . 36.9 m -87.83 -46.39 9.47 Favored 'General case' 0 C--O 1.247 0.963 0 CA-C-N 119.442 1.019 . . . . 30.760000000000002 111.578 -179.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 89' ' ' LEU . . . . . 0.412 ' HB3' HD11 ' G' ' 83' ' ' LEU . 66.3 mt -88.16 -34.78 17.72 Favored 'General case' 0 C--O 1.251 1.181 0 N-CA-C 113.628 0.973 . . . . 33.359999999999999 113.628 -174.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 90' ' ' GLY . . . . . . . . . . . . . . . -49.1 -47.7 32.76 Favored Glycine 0 N--CA 1.44 -1.042 0 C-N-CA 125.149 1.357 . . . . 25.809999999999999 115.593 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 91' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -71.91 -9.08 24.17 Favored 'Trans proline' 0 C--O 1.245 0.861 0 CA-C-N 119.06 1.43 . . . . 26.190000000000001 114.369 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 92' ' ' GLN . . . . . . . . . . . . . 73.3 mm-40 -97.85 -2.84 39.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 112.958 0.725 . . . . 71.5 112.958 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 93' ' ' ILE . . . . . . . . . . . . . 19.5 tt -123.83 146.09 29.84 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.156 0 N-CA-C 108.551 -0.907 . . . . 29.670000000000002 108.551 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 94' ' ' THR . . . . . . . . . . . . . 42.5 p -94.0 160.11 32.98 Favored Pre-proline 0 C--N 1.307 -1.244 0 CA-C-N 115.654 -0.703 . . . . 35.710000000000001 111.225 179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 95' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -58.34 -38.04 92.35 Favored 'Trans proline' 0 C--O 1.241 0.668 0 N-CA-C 114.435 0.898 . . . . 33.920000000000002 114.435 176.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 96' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.92 -40.68 89.66 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.155 0.502 . . . . 82.900000000000006 111.297 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 97' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -64.97 -39.73 93.92 Favored 'General case' 0 N--CA 1.467 0.414 0 O-C-N 121.469 -0.77 . . . . 26.07 110.978 177.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 98' ' ' VAL . . . . . . . . . . . . . 90.5 t -56.91 -48.53 81.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.653 0 C-N-CA 120.157 -0.617 . . . . 30.690000000000001 111.141 175.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 99' ' ' ARG . . . . . . . . . . . . . 7.5 ttm105 -57.45 -47.27 82.25 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.371 -0.831 . . . . 153.61000000000001 111.575 176.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 100' ' ' THR . . . . . . . . . . . . . 26.0 m -56.81 -48.11 78.7 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.648 0.737 . . . . 29.300000000000001 111.395 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 101' ' ' LEU . . . . . . . . . . . . . 93.3 mt -65.2 -36.19 83.4 Favored 'General case' 0 C--O 1.243 0.747 0 O-C-N 121.639 -0.663 . . . . 27.879999999999999 110.638 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 102' ' ' SER . . . . . . . . . . . . . 32.7 p -61.52 -17.09 53.22 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 120.196 -0.602 . . . . 30.539999999999999 111.595 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 103' ' ' ARG . . . . . . . . . . . . . 34.3 mtt180 -88.29 4.05 47.4 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 113.931 1.086 . . . . 92.180000000000007 113.931 178.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 104' ' ' ILE . . . . . . . . . . . . . 94.8 mt -90.67 118.07 35.18 Favored 'Isoleucine or valine' 0 C--O 1.237 0.433 0 CA-C-N 119.867 1.212 . . . . 29.640000000000001 109.476 -178.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 105' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -160.88 153.17 20.32 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 122.737 0.415 . . . . 100.31 110.046 -178.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 106' ' ' LEU . . . . . 0.449 HD23 ' HE3' ' G' ' 109' ' ' LYS . 6.7 tp -137.63 101.53 4.5 Favored 'General case' 0 N--CA 1.463 0.213 0 N-CA-C 106.295 -1.743 . . . . 53.030000000000001 106.295 176.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 107' ' ' ARG . . . . . 1.5 ' CB ' ' CG ' ' G' ' 107' ' ' ARG 0.278 19.2 mmt180 61.31 31.95 19.28 Favored 'General case' 0 C--N 1.313 -1.004 0 O-C-N 121.238 -0.914 . . . . 64.269999999999996 112.451 175.077 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' G' G ' 108' ' ' GLY . . . . . . . . . . . . . . . 93.16 -18.24 56.62 Favored Glycine 0 N--CA 1.441 -1.008 0 C-N-CA 118.45 -1.833 . . . . 49.549999999999997 114.896 -173.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 109' ' ' LYS . . . . . 0.449 ' HE3' HD23 ' G' ' 106' ' ' LEU . 7.7 mtmt -83.83 134.15 34.72 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 119.126 1.463 . . . . 86.010000000000005 110.497 178.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 110' ' ' ARG . . . . . 0.835 ' NH2' ' O ' ' G' ' 302' ' ' HOH . 6.8 mtm-85 -139.29 155.75 72.15 Favored Pre-proline 0 C--N 1.316 -0.849 0 N-CA-C 106.449 -1.685 . . . . 156.78999999999999 106.449 -175.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 111' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -52.07 148.05 25.13 Favored 'Trans proline' 0 CA--C 1.513 -0.542 0 N-CA-C 109.219 -1.108 . . . . 38.240000000000002 109.219 166.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 112' ' ' ARG . . . . . 0.414 HH12 ' HB2' ' G' ' 110' ' ' ARG . 45.4 mmt-85 -101.19 -65.03 1.0 Allowed 'General case' 0 C--O 1.234 0.242 0 C-N-CA 118.416 -1.314 . . . . 163.31999999999999 113.598 -172.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 113' ' ' ASP . . . . . . . . . . . . . 32.9 p30 -97.69 169.59 9.58 Favored 'General case' 0 C--O 1.245 0.862 0 CA-C-O 123.08 1.419 . . . . 66.909999999999997 112.464 -172.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 114' ' ' LYS . . . . . . . . . . . . . 20.1 pttt -60.72 -38.17 84.19 Favored 'General case' 0 C--O 1.243 0.741 0 CA-C-N 114.458 -1.247 . . . . 44.710000000000001 111.097 -171.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 115' ' ' GLN . . . . . 0.818 ' OE1' ' OH ' ' H' ' 118' ' ' TYR . 25.5 mp0 -67.29 -32.92 74.24 Favored 'General case' 0 C--O 1.245 0.853 0 CA-C-O 121.038 0.447 . . . . 59.710000000000001 111.608 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 116' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -65.34 -43.16 91.75 Favored 'General case' 0 C--O 1.245 0.834 0 CA-C-O 120.861 0.362 . . . . 43.189999999999998 111.146 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 117' ' ' TRP . . . . . . . . . . . . . 57.9 m95 -62.37 -39.23 92.49 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.351 -0.539 . . . . 29.199999999999999 110.987 174.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 118' ' ' TYR . . . . . . . . . . . . . 21.0 t80 -68.79 -38.53 80.05 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 120.096 -0.642 . . . . 34.829999999999998 110.925 -177.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 119' ' ' GLU . . . . . . . . . . . . . 53.3 tt0 -57.27 -48.44 78.88 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.7 0.762 . . . . 27.34 109.829 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 120' ' ' ILE . . . . . . . . . . . . . 50.8 mt -63.17 -45.65 97.96 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 O-C-N 121.659 -0.651 . . . . 62.530000000000001 111.145 177.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 121' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -53.58 -50.76 64.9 Favored 'General case' 0 N--CA 1.44 -0.927 0 N-CA-C 112.184 0.439 . . . . 28.600000000000001 112.184 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 122' ' ' LEU . . . . . . . . . . . . . 59.9 mt -59.05 -42.66 90.8 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.565 -0.454 . . . . 22.780000000000001 110.624 -176.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 123' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -68.08 -46.55 70.7 Favored 'General case' 0 C--N 1.326 -0.414 0 O-C-N 121.285 -0.885 . . . . 20.030000000000001 111.566 179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 124' ' ' LEU . . . . . . . . . . . . . 20.5 mt -63.88 -36.14 82.97 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 121.853 -0.529 . . . . 27.350000000000001 111.641 -177.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 125' ' ' LYS . . . . . 0.863 ' NZ ' ' O ' ' G' ' 301' ' ' HOH . 1.6 pttp -63.08 -29.09 70.54 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 119.714 -0.794 . . . . 86.629999999999995 111.72 -178.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 126' ' ' ARG . . . . . . . . . . . . . 39.7 ttm-85 -72.24 -16.46 61.93 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 113.509 0.929 . . . . 42.939999999999998 113.509 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 127' ' ' ILE . . . . . . . . . . . . . 96.6 mt -105.09 -49.77 9.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 N-CA-C 112.736 0.643 . . . . 28.469999999999999 112.736 -170.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 128' ' ' LEU . . . . . . . . . . . . . 9.7 mp -63.37 134.6 56.01 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 120.981 -1.075 . . . . 36.539999999999999 112.217 -171.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 129' ' ' SER . . . . . . . . . . . . . 59.9 p . . . . . 0 C--O 1.258 1.536 0 N-CA-C 113.014 0.746 . . . . 39.009999999999998 113.014 176.559 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 75' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.326 0 CA-C-O 120.97 0.414 . . . . 56.700000000000003 111.162 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 76' ' ' LEU . . . . . . . . . . . . . 38.6 mt -69.4 149.2 97.28 Favored Pre-proline 0 C--N 1.327 -0.386 0 C-N-CA 118.948 -1.101 . . . . 53.810000000000002 109.635 167.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 77' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_exo -54.43 142.64 69.41 Favored 'Trans proline' 0 C--O 1.237 0.427 0 N-CA-C 109.034 -1.179 . . . . 37.579999999999998 109.034 170.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 78' ' ' LYS . . . . . 0.429 ' HB2' ' HE2' ' H' ' 78' ' ' LYS . 0.8 OUTLIER -65.91 -35.04 79.53 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 120.456 -0.498 . . . . 92.75 111.616 -169.731 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' H' H ' 79' ' ' GLY . . . . . . . . . . . . . . . -65.74 -32.21 82.26 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 119.071 -1.537 . . . . 30.449999999999999 112.955 177.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 80' ' ' LEU . . . . . . . . . . . . . 34.1 tp -75.75 -38.97 57.92 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.557 -0.967 . . . . 29.530000000000001 109.675 -179.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 81' ' ' SER . . . . . . . . . . . . . 22.8 t -57.79 -41.62 82.48 Favored 'General case' 0 C--O 1.251 1.147 0 C-N-CA 119.48 -0.888 . . . . 37.530000000000001 110.741 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 82' ' ' ASP . . . . . . . . . . . . . 83.2 m-20 -62.29 -44.71 95.89 Favored 'General case' 0 C--O 1.241 0.626 0 O-C-N 120.232 -1.543 . . . . 43.899999999999999 111.103 176.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 83' ' ' LEU . . . . . . . . . . . . . 27.4 tp -57.25 -45.4 83.99 Favored 'General case' 0 C--O 1.241 0.652 0 CA-C-O 120.934 0.397 . . . . 38.009999999999998 111.523 -178.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 84' ' ' ILE . . . . . . . . . . . . . 41.9 pt -72.46 -24.16 21.7 Favored 'Isoleucine or valine' 0 C--O 1.243 0.735 0 C-N-CA 119.648 -0.821 . . . . 54.969999999999999 110.439 -173.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.2 -13.13 57.59 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 113.778 1.029 . . . . 36.990000000000002 113.778 175.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 86' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -60.05 122.64 67.72 Favored Pre-proline 0 C--O 1.247 0.937 0 N-CA-C 108.102 -1.073 . . . . 42.0 108.102 177.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 87' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -62.48 -21.01 72.24 Favored 'Trans proline' 0 C--O 1.238 0.52 0 CA-C-N 119.026 0.688 . . . . 80.950000000000003 113.455 -175.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 88' ' ' THR . . . . . . . . . . . . . 99.4 m -104.49 -40.81 5.92 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 113.093 0.775 . . . . 50.829999999999998 113.093 -178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 89' ' ' LEU . . . . . . . . . . . . . 30.5 mt -84.78 -29.42 25.46 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 119.579 -0.848 . . . . 42.68 111.552 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 90' ' ' GLY . . . . . . . . . . . . . . . -66.33 -41.54 94.5 Favored Glycine 0 N--CA 1.444 -0.808 0 N-CA-C 115.045 0.778 . . . . 37.520000000000003 115.045 -172.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 91' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -54.16 -31.83 67.41 Favored 'Trans proline' 0 CA--C 1.51 -0.696 0 N-CA-C 114.191 0.804 . . . . 47.240000000000002 114.191 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 92' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -74.91 -25.26 58.8 Favored 'General case' 0 C--O 1.244 0.773 0 N-CA-C 112.863 0.69 . . . . 93.349999999999994 112.863 -176.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 93' ' ' ILE . . . . . . . . . . . . . 34.4 mt -81.6 119.42 31.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 N-CA-C 109.45 -0.574 . . . . 37.149999999999999 109.45 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 94' ' ' THR . . . . . . . . . . . . . 73.1 p -84.26 163.37 48.09 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-O 120.874 0.369 . . . . 36.280000000000001 111.189 -178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 95' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -55.02 -34.21 86.14 Favored 'Trans proline' 0 C--O 1.243 0.732 0 N-CA-C 113.823 0.663 . . . . 43.390000000000001 113.823 173.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 96' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -62.26 -42.86 99.7 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.967 -0.693 . . . . 55.460000000000001 111.805 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 97' ' ' TRP . . . . . . . . . . . . . 46.4 m95 -64.88 -36.78 85.47 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 119.759 -0.776 . . . . 36.560000000000002 111.698 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 98' ' ' VAL . . . . . . . . . . . . . 70.7 t -61.27 -45.29 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 C-N-CA 119.391 -0.924 . . . . 33.649999999999999 110.44 177.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 99' ' ' ARG . . . . . . . . . . . . . 13.0 mtm105 -59.39 -48.66 80.78 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 119.983 -0.687 . . . . 93.890000000000001 110.522 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 100' ' ' THR . . . . . . . . . . . . . 69.2 m -59.09 -49.4 78.02 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-O 120.935 0.398 . . . . 27.420000000000002 110.791 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' LEU . . . . . . . . . . . . . 64.6 mt -65.12 -41.05 95.23 Favored 'General case' 0 CA--C 1.513 -0.443 0 C-N-CA 119.899 -0.72 . . . . 24.960000000000001 110.79 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' SER . . . . . . . . . . . . . 42.8 p -61.69 -22.19 65.11 Favored 'General case' 0 CA--C 1.51 -0.594 0 CA-C-O 121.828 0.823 . . . . 36.039999999999999 109.871 -170.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' ARG . . . . . . . . . . . . 0.802 14.4 mtt85 -57.93 -50.19 74.21 Favored 'General case' 0 CA--C 1.476 -1.882 0 CA-C-O 123.708 1.718 . . . . 117.70999999999999 111.665 174.361 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' ILE . . . . . . . . . . . . 0.268 67.9 mt -49.82 111.77 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.961 0 CA-C-N 112.696 -2.047 . . . . 37.899999999999999 109.047 -152.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 105' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -157.74 146.23 19.2 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.068 1.136 . . . . 91.239999999999995 114.068 -178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 106' ' ' LEU . . . . . . . . . . . . . 20.0 tp -130.02 106.95 8.98 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 122.962 0.505 . . . . 58.539999999999999 110.291 173.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 107' ' ' ARG . . . . . . . . . . . . . 88.7 mtm-85 51.05 40.96 26.84 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.71 0.767 . . . . 80.739999999999995 111.092 -178.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 108' ' ' GLY . . . . . . . . . . . . . . . 88.23 -16.3 52.91 Favored Glycine 0 N--CA 1.44 -1.047 0 CA-C-O 119.004 -0.887 . . . . 57.990000000000002 115.293 -179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 109' ' ' LYS . . . . . . . . . . . . . 11.7 mtmt -79.07 134.32 36.75 Favored 'General case' 0 CA--C 1.52 -0.187 0 CA-C-N 118.835 1.318 . . . . 93.480000000000004 110.41 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 110' ' ' ARG . . . . . . . . . . . . . 80.7 mtt85 -132.21 161.11 64.88 Favored Pre-proline 0 C--O 1.244 0.797 0 C-N-CA 124.265 1.026 . . . . 103.27 109.277 -177.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 111' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_exo -52.99 149.64 26.04 Favored 'Trans proline' 0 C--N 1.33 -0.433 0 N-CA-C 109.076 -1.163 . . . . 43.450000000000003 109.076 167.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 112' ' ' ARG . . . . . . . . . . . . . 50.7 mtp85 -88.84 -76.98 0.39 Allowed 'General case' 0 C--N 1.338 0.102 0 CA-C-N 116.25 -0.432 . . . . 120.94 112.022 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 113' ' ' ASP . . . . . . . . . . . . . 27.8 p30 -106.48 175.27 5.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 123.118 1.437 . . . . 62.049999999999997 111.77 -168.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 114' ' ' LYS . . . . . . . . . . . . . 33.7 ttpt -50.16 -45.0 52.94 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 114.153 -1.385 . . . . 61.759999999999998 111.863 -176.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 115' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' H' ' 209' ' ' HOH . 84.2 mm-40 -63.63 -36.38 83.64 Favored 'General case' 0 C--N 1.347 0.479 0 C-N-CA 119.54 -0.864 . . . . 46.07 111.121 -176.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 116' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -65.1 -42.96 93.53 Favored 'General case' 0 C--O 1.246 0.911 0 N-CA-C 112.137 0.421 . . . . 49.43 112.137 176.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 117' ' ' TRP . . . . . . . . . . . . . 87.4 m95 -64.48 -41.27 96.58 Favored 'General case' 0 CA--C 1.512 -0.491 0 O-C-N 121.84 -0.537 . . . . 29.93 111.469 176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 118' ' ' TYR . . . . . 0.818 ' OH ' ' OE1' ' G' ' 115' ' ' GLN . 11.7 t80 -64.25 -40.66 96.45 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 120.139 -0.625 . . . . 44.159999999999997 110.709 179.135 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 119' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -53.88 -50.37 66.47 Favored 'General case' 0 C--O 1.233 0.196 0 O-C-N 122.052 -0.405 . . . . 23.219999999999999 111.474 175.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 120' ' ' ILE . . . . . . . . . . . . . 76.5 mt -71.44 -37.61 65.35 Favored 'Isoleucine or valine' 0 C--O 1.244 0.775 0 CA-C-O 121.565 0.698 . . . . 31.989999999999998 110.966 -178.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 121' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -57.99 -48.56 79.64 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 122.04 -0.413 . . . . 36.450000000000003 110.636 -179.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 122' ' ' LEU . . . . . . . . . . . . . 79.1 mt -59.68 -43.89 93.84 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 120.026 -0.67 . . . . 26.510000000000002 110.897 -177.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 123' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -69.8 -44.6 69.71 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 118.563 -1.255 . . . . 24.25 111.532 -178.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 124' ' ' LEU . . . . . . . . . . . . . 61.1 mt -65.72 -34.66 78.7 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.443 -0.903 . . . . 23.41 111.548 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 125' ' ' LYS . . . . . 1.029 ' NZ ' ' O ' ' H' ' 201' ' ' HOH . 9.7 ttpp -63.45 -25.64 68.37 Favored 'General case' 0 C--O 1.242 0.674 0 C-N-CA 119.684 -0.806 . . . . 109.22 111.04 -177.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 126' ' ' ARG . . . . . . . . . . . . . 54.6 ttm-85 -79.38 -17.08 55.14 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 119.104 -0.474 . . . . 46.729999999999997 112.01 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 127' ' ' ILE . . . . . . . . . . . . . 87.8 mt -102.62 -47.57 10.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 C-N-CA 123.081 0.552 . . . . 36.32 111.996 -170.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 128' ' ' LEU . . . . . . . . . . . . . 10.1 mp -68.04 133.12 48.49 Favored 'General case' 0 C--N 1.323 -0.564 0 O-C-N 121.321 -0.862 . . . . 32.240000000000002 112.016 -169.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 129' ' ' SER . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.26 1.628 0 CA-C-O 125.094 2.378 . . . . 51.170000000000002 112.009 -177.884 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' SO4 . . . . . 0.837 ' O3 ' ' NH2' ' C' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 201' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 201' ' ' SO4 . . . . . 0.558 ' O4 ' ' NH2' ' G' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.867 ' O ' ' NH2' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' HOH . . . . . 1.155 ' O ' ' NH2' ' B' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' 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 ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . 001 ecloud nobuild full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 301' ' ' HOH . . . . . 0.48 ' O ' ' OE1' ' E' ' 105' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 301' ' ' HOH . . . . . 0.787 ' O ' ' OG ' ' F' ' 81' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 301' ' ' HOH . . . . . 0.863 ' O ' ' NZ ' ' G' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 302' ' ' HOH . . . . . 0.835 ' O ' ' NH2' ' G' ' 110' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 201' ' ' HOH . . . . . 1.029 ' O ' ' NZ ' ' H' ' 125' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 209' ' ' HOH . . . . . 0.478 ' O ' ' HG2' ' H' ' 115' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_