data_4lh5_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4lh5 _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 57' ' ' SER . . . . . 0.614 ' N ' ' O ' ' A' ' 483' ' ' HOH . 1.2 t . . . . . 0 N--CA 1.51 2.545 0 N-CA-C 112.642 0.608 . . . . 59.54 112.642 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.56 -16.4 34.18 Favored 'Trans proline' 0 N--CA 1.485 1.004 0 C-N-CA 123.295 2.663 . . . . 49.87 118.436 -160.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.73 6.65 58.91 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 118.99 -0.894 . . . . 34.47 111.916 -173.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.8 mt -101.13 125.9 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 115.092 1.516 . . . . 47.53 115.092 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -123.7 149.8 45.07 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.78 1.632 . . . . 30.82 108.525 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -112.27 141.48 45.93 Favored 'General case' 0 N--CA 1.415 -2.191 0 C-N-CA 123.923 0.889 . . . . 40.74 110.901 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.6 tp -134.32 129.79 36.02 Favored 'General case' 0 C--O 1.256 1.425 0 N-CA-C 107.287 -1.375 . . . . 46.7 107.287 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -150.55 160.11 44.02 Favored 'General case' 0 CA--C 1.499 -1.01 0 C-N-CA 124.038 0.935 . . . . 38.29 109.013 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CAS . . . . . 0.443 ' CE2' ' O ' ' A' ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . 0.25 0.2 OUTLIER -117.98 172.26 7.53 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 123.824 0.702 . . . . 52.15 111.376 162.795 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -120.89 141.77 50.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 114.522 -1.217 . . . . 56.53 111.144 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -162.88 131.81 4.08 Favored 'General case' 0 CA--C 1.476 -1.888 0 N-CA-C 106.391 -1.707 . . . . 52.05 106.391 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 50.81 35.63 12.64 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 113.707 1.002 . . . . 45.98 113.707 -178.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.17 19.92 77.67 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 119.924 -1.131 . . . . 42.18 113.818 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -127.1 169.76 13.07 Favored 'General case' 0 C--O 1.265 1.89 0 O-C-N 121.793 -0.828 . . . . 61.59 109.693 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -114.16 136.85 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.108 0 CA-C-N 114.425 -1.261 . . . . 37.89 109.579 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.7 mt -123.81 120.19 59.07 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.086 0 O-C-N 124.452 1.095 . . . . 43.23 108.091 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tt -92.31 129.45 38.25 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.658 -1.979 . . . . 49.11 105.658 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 97.4 t -129.81 121.76 53.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.193 -1.41 . . . . 31.49 107.193 -171.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -110.72 132.8 53.88 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.758 1.623 . . . . 28.89 108.261 173.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.4 t -122.37 127.63 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.958 0 C-N-CA 125.119 1.368 . . . . 29.27 108.083 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 77.1 t60 -84.66 112.91 20.89 Favored 'General case' 0 C--O 1.267 2.003 0 N-CA-C 106.247 -1.76 . . . . 30.54 106.247 173.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.93 -45.15 91.86 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.064 -1.055 . . . . 47.01 109.611 -158.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -32.83 71.98 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 115.53 1.678 . . . . 42.36 115.53 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.7 p -104.69 -26.09 12.43 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 119.674 1.124 . . . . 37.65 113.326 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.35 8.12 75.12 Favored Glycine 0 CA--C 1.55 2.27 0 O-C-N 121.607 -0.683 . . . . 30.28 111.407 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -71.99 138.45 48.0 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 109.202 -0.666 . . . . 34.46 109.202 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 pt -120.96 153.75 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 N-CA-C 116.04 1.866 . . . . 57.77 116.04 173.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . 0.761 ' OE1' ' NH1' ' A' ' 107' ' ' ARG . 72.0 mt-10 -128.37 148.58 50.7 Favored 'General case' 0 CA--C 1.472 -2.022 0 CA-C-N 113.522 -1.672 . . . . 35.66 107.818 161.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -151.7 154.95 37.33 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.899 -0.591 . . . . 35.97 111.065 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -143.74 147.76 34.68 Favored 'General case' 0 C--O 1.264 1.843 0 N-CA-C 104.901 -2.259 . . . . 50.18 104.901 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.25 128.76 41.97 Favored 'Isoleucine or valine' 0 C--O 1.267 2.007 0 N-CA-C 108.156 -1.053 . . . . 34.06 108.156 167.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 pt -120.86 153.32 57.1 Favored Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.446 1.091 . . . . 44.74 111.832 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -62.84 -59.86 0.21 Allowed 'Trans proline' 0 C--O 1.26 1.575 0 N-CA-C 107.445 -1.79 . . . . 63.81 107.445 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -122.42 143.95 49.35 Favored 'General case' 0 C--O 1.21 -1.014 0 O-C-N 125.193 1.558 . . . . 56.92 109.891 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.67 81.55 0.1 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 123.881 0.872 . . . . 55.94 110.611 164.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.36 157.61 40.54 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 114.406 1.261 . . . . 61.23 114.406 -175.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.12 -43.65 83.56 Favored Glycine 0 C--O 1.212 -1.26 0 O-C-N 124.909 1.381 . . . . 37.84 111.946 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -58.09 -42.63 86.01 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 115.5 1.667 . . . . 63.97 115.5 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -71.69 -39.96 69.88 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.072 -1.085 . . . . 52.26 108.072 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.9 m -60.92 -44.62 96.93 Favored 'General case' 0 CA--C 1.562 1.437 0 CA-C-O 121.019 0.438 . . . . 28.07 110.194 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.43 -47.18 86.94 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.026 0.917 . . . . 25.25 110.94 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -62.5 -40.04 95.43 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 123.202 1.477 . . . . 32.7 110.582 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -65.52 -41.55 93.02 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 114.546 -1.206 . . . . 35.57 111.612 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.7 mt -61.05 -43.34 99.04 Favored 'General case' 0 C--O 1.188 -2.143 0 CA-C-N 115.536 -0.757 . . . . 32.08 111.72 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.6 -44.1 85.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.853 -0.529 . . . . 29.86 110.798 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.49 -47.96 76.99 Favored 'General case' 0 CA--C 1.48 -1.723 0 O-C-N 123.517 0.511 . . . . 58.04 111.469 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.8 tp -56.03 -48.85 75.2 Favored 'General case' 0 C--O 1.268 2.061 0 C-N-CA 120.079 -0.649 . . . . 28.77 111.635 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.67 -25.28 68.14 Favored 'General case' 0 C--O 1.204 -1.337 0 N-CA-C 112.626 0.602 . . . . 26.37 112.626 -172.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.96 81.0 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 121.844 -0.217 . . . . 26.94 113.622 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . 0.761 ' NH1' ' OE1' ' A' ' 85' ' ' GLU . 60.9 mtt85 -98.16 -44.2 6.7 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 119.004 -0.522 . . . . 54.87 112.018 -178.727 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -120.9 161.35 40.68 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 109.265 -0.643 . . . . 30.44 109.265 -174.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -83.94 88.86 1.04 Allowed 'Trans proline' 0 N--CA 1.485 0.995 0 N-CA-C 107.824 -1.645 . . . . 38.1 107.824 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 92.9 t -89.82 116.07 30.55 Favored 'Isoleucine or valine' 0 C--O 1.254 1.323 0 N-CA-C 107.286 -1.376 . . . . 33.0 107.286 -171.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . 0.412 ' CE ' ' O ' ' A' ' 475' ' ' HOH . 29.8 mmtp -104.4 -45.23 4.72 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 122.392 1.091 . . . . 71.46 110.778 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 39.1 p -139.09 147.07 41.51 Favored 'General case' 0 C--O 1.267 1.989 0 C-N-CA 118.998 -1.081 . . . . 40.37 112.003 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.8 t -125.86 135.53 63.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 113.818 -1.537 . . . . 33.35 111.726 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 413' ' ' HOH . 24.9 m170 -118.25 159.11 23.92 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 124.316 1.047 . . . . 76.23 110.298 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 8.8 t -149.81 158.81 44.53 Favored 'General case' 0 C--O 1.255 1.376 0 N-CA-C 107.221 -1.4 . . . . 32.66 107.221 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 -87.78 -7.61 57.08 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 124.759 1.287 . . . . 55.39 110.534 175.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -131.34 94.87 3.64 Favored 'General case' 0 CA--C 1.482 -1.639 0 CA-C-N 118.688 0.676 . . . . 36.45 109.561 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.05 -29.4 68.06 Favored Glycine 0 C--O 1.265 2.085 0 CA-C-N 115.159 -0.928 . . . . 24.52 113.803 -172.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 28.9 p -61.97 -15.41 43.53 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 118.245 -1.382 . . . . 29.06 113.342 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -54.32 -33.4 58.8 Favored 'General case' 0 C--O 1.193 -1.878 0 O-C-N 121.124 -0.985 . . . . 34.62 112.63 174.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -105.3 25.2 10.93 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 114.108 1.151 . . . . 37.64 114.108 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' THR . . . . . 0.454 ' CG2' ' O ' ' A' ' 436' ' ' HOH . 0.3 OUTLIER -88.77 -29.13 20.01 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.024 -0.989 . . . . 45.78 112.506 -172.104 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 64.5 p -62.99 154.11 31.62 Favored 'General case' 0 C--O 1.206 -1.185 0 O-C-N 119.997 -1.689 . . . . 40.0 113.632 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 98.1 m -59.93 -32.86 71.18 Favored 'General case' 0 C--O 1.197 -1.68 0 CA-C-N 112.459 -2.155 . . . . 42.78 109.182 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.0 p -70.39 -43.99 68.93 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.4 -0.593 . . . . 35.46 109.4 -175.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 72.2 t -66.45 -45.83 88.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-O 121.971 0.891 . . . . 28.2 110.867 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -60.58 -39.39 87.91 Favored 'General case' 0 N--CA 1.428 -1.538 0 O-C-N 121.566 -0.709 . . . . 58.53 111.594 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.85 95.54 Favored 'General case' 0 CA--C 1.558 1.284 0 N-CA-C 112.783 0.66 . . . . 27.22 112.783 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.2 -47.87 78.08 Favored 'General case' 0 C--O 1.281 2.717 0 O-C-N 120.207 -1.558 . . . . 27.05 110.962 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.9 t90 -54.65 -53.42 55.07 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.731 0.641 . . . . 31.98 112.731 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 80.7 t90 -65.41 -37.67 87.65 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-O 123.006 1.384 . . . . 29.81 110.773 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.15 -2.89 58.87 Favored 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 120.56 -1.338 . . . . 30.65 113.474 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.12 38.76 39.11 Favored Glycine 0 C--O 1.206 -1.652 0 C-N-CA 119.974 -1.108 . . . . 31.19 113.909 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 83.4 mt -110.07 145.61 16.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.023 0 O-C-N 120.482 -1.599 . . . . 33.75 107.88 -175.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.61 160.65 17.65 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 114.338 1.236 . . . . 86.6 114.338 167.802 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 C--N 1.312 -1.042 0 O-C-N 120.671 -1.268 . . . . 57.3 112.873 172.918 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.175 0 CA-C-O 119.684 -0.198 . . . . 77.02 111.303 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASN . . . . . . . . . . . . . 47.4 t-20 -34.74 -53.46 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.024 0.916 . . . . 99.95 113.006 174.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.15 -40.43 37.97 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 113.574 0.953 . . . . 112.66 113.574 -173.581 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.28 -47.08 87.51 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 122.245 1.021 . . . . 83.62 109.803 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 27.9 tp -62.37 -48.46 79.69 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 121.622 -0.674 . . . . 58.28 110.856 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -31.78 70.12 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.367 -0.933 . . . . 64.68 112.627 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.83 -56.3 18.66 Favored 'General case' 0 C--O 1.197 -1.699 0 N-CA-C 107.876 -1.157 . . . . 90.01 107.876 176.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 59.9 mt -57.95 -44.17 86.19 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 C-N-CA 120.414 -0.514 . . . . 45.33 111.609 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 57.2 mt -55.5 -46.41 78.83 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 N-CA-C 108.231 -1.026 . . . . 41.14 108.231 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -63.39 -38.95 97.2 Favored Glycine 0 N--CA 1.504 3.214 0 C-N-CA 119.316 -1.421 . . . . 43.72 112.223 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.42 -30.11 66.63 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 116.74 2.126 . . . . 52.36 116.74 170.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.3 m -109.08 -3.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.473 -2.006 0 CA-C-N 119.212 0.915 . . . . 43.14 111.251 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -60.26 -35.94 76.66 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 117.577 2.436 . . . . 45.38 117.577 -166.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ASP . . . . . 0.406 ' N ' ' O ' ' A' ' 481' ' ' HOH . 7.7 p-10 -69.99 -19.03 63.35 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.454 -0.794 . . . . 81.67 110.673 -178.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLN . . . . . 0.647 ' OE1' ' O ' ' A' ' 479' ' ' HOH . 28.5 mt-30 -85.01 -3.5 58.81 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 116.535 2.05 . . . . 55.98 116.535 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -129.41 151.15 50.36 Favored 'General case' 0 CA--C 1.483 -1.608 0 C-N-CA 116.979 -1.888 . . . . 48.97 107.403 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -75.54 -48.88 20.52 Favored 'General case' 0 N--CA 1.415 -2.188 0 O-C-N 124.143 0.902 . . . . 57.03 112.035 172.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -96.23 142.46 28.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.949 1.357 . . . . 44.04 110.886 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 64.2 tp -53.3 -39.14 63.77 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 114.917 -1.038 . . . . 36.78 110.596 175.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -66.83 -33.46 75.65 Favored 'General case' 0 C--O 1.248 0.994 0 O-C-N 120.399 -1.438 . . . . 41.41 108.323 -170.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.1 m -63.51 -48.52 77.23 Favored 'General case' 0 C--O 1.257 1.49 0 CA-C-O 122.24 1.019 . . . . 28.58 113.581 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.91 -40.45 73.09 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 114.182 1.179 . . . . 29.21 114.182 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.5 -45.74 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-O 121.579 0.704 . . . . 29.32 111.637 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -65.8 -38.34 88.7 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 117.419 -1.712 . . . . 31.67 111.76 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 92.2 mtp -55.23 -42.73 73.78 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 119.758 -0.777 . . . . 31.41 111.941 170.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -75.07 -31.48 61.24 Favored 'General case' 0 CA--C 1.488 -1.434 0 C-N-CA 118.759 -1.176 . . . . 28.18 112.32 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.0 t -63.6 -46.62 94.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.267 0 C-N-CA 118.097 -1.441 . . . . 26.79 111.674 173.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -52.94 -53.44 49.55 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 115.409 -0.814 . . . . 32.02 112.04 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 35.0 mt -59.52 -47.18 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 107.029 -1.471 . . . . 34.76 107.029 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -60.8 -47.13 87.73 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-O 122.142 0.972 . . . . 42.42 112.23 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -71.94 -28.03 63.18 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.062 -1.649 . . . . 31.35 113.193 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -88.6 -25.94 22.19 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 114.096 1.147 . . . . 47.83 114.096 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -50.04 131.69 23.1 Favored 'General case' 0 C--O 1.204 -1.338 0 N-CA-C 113.162 0.801 . . . . 71.6 113.162 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -89.8 144.68 25.76 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.662 1.356 . . . . 86.28 114.662 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' LYS . . . . . . . . . . . . . 45.1 mttm . . . . . 0 N--CA 1.485 1.294 0 C-N-CA 127.1 2.16 . . . . 102.65 115.438 -172.237 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' TYR . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 114.539 1.311 . . . . 100.06 114.539 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 99.9 p -88.42 159.65 17.91 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 107.239 -1.393 . . . . 37.81 107.239 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -53.14 -41.82 65.46 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 119.025 -1.07 . . . . 33.7 113.43 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.88 -34.13 86.11 Favored Glycine 0 C--O 1.269 2.339 0 O-C-N 119.927 -1.733 . . . . 33.0 113.933 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -77.32 -38.63 50.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 114.498 -0.851 . . . . 51.56 109.553 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 72.3 mtm-85 -61.59 -45.83 92.43 Favored 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 118.233 -1.387 . . . . 65.49 111.926 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 16.7 tt -57.57 -48.2 83.63 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 C-N-CA 117.717 -1.593 . . . . 36.97 111.209 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.95 -40.26 88.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 C-N-CA 119.154 -1.018 . . . . 49.63 108.525 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.32 -50.86 66.15 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 118.405 -1.318 . . . . 63.0 111.088 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 95.2 mt -52.95 -46.57 53.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 O-C-N 121.468 -0.77 . . . . 45.69 111.063 176.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 19.6 mm -72.5 -43.83 62.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.18 1.178 . . . . 51.46 114.18 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.4 79.25 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.72 0.295 . . . . 53.36 110.25 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 23.9 m -56.15 -37.9 70.13 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 115.721 -0.672 . . . . 60.72 111.22 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.42 -21.08 58.49 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 115.059 1.503 . . . . 70.2 115.059 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.484 1.24 0 CA-C-N 118.587 0.63 . . . . 79.59 112.598 -171.059 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' LF0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 409' ' ' HOH . . . . . 0.443 ' O ' ' CE2' ' A' ' 65' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 413' ' ' HOH . . . . . 0.525 ' O ' ' CD2' ' A' ' 114' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 436' ' ' HOH . . . . . 0.454 ' O ' ' CG2' ' A' ' 122' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 473' ' ' HOH . . . . . 0.712 ' O ' ' NE ' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 474' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 475' ' ' HOH . . . . . 0.412 ' O ' ' CE ' ' A' ' 111' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 479' ' ' HOH . . . . . 0.647 ' O ' ' OE1' ' A' ' 168' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 481' ' ' HOH . . . . . 0.406 ' O ' ' N ' ' A' ' 167' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 483' ' ' HOH . . . . . 0.614 ' O ' ' N ' ' A' ' 57' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 489' ' ' HOH . . . . . 0.505 ' O ' ' CD ' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . 0.614 ' N ' ' O ' ' A' ' 483' ' ' HOH . 1.2 t . . . . . 0 N--CA 1.51 2.545 0 N-CA-C 112.642 0.608 . . . . 59.539999999999999 112.642 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -70.56 -16.4 34.18 Favored 'Trans proline' 0 N--CA 1.485 1.004 0 C-N-CA 123.295 2.663 . . . . 49.869999999999997 118.436 -160.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.73 6.65 58.91 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 118.99 -0.894 . . . . 34.469999999999999 111.916 -173.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.8 mt -101.13 125.9 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 115.092 1.516 . . . . 47.530000000000001 115.092 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -123.7 149.8 45.07 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.78 1.632 . . . . 30.82 108.525 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -112.27 141.48 45.93 Favored 'General case' 0 N--CA 1.415 -2.191 0 C-N-CA 123.923 0.889 . . . . 40.740000000000002 110.901 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.6 tp -134.32 129.79 36.02 Favored 'General case' 0 C--O 1.256 1.425 0 N-CA-C 107.287 -1.375 . . . . 46.700000000000003 107.287 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -150.55 160.11 44.02 Favored 'General case' 0 CA--C 1.499 -1.01 0 C-N-CA 124.038 0.935 . . . . 38.289999999999999 109.013 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CAS . . . . . 0.443 ' CE2' ' O ' ' A' ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.513 HG23 HD21 ' A' ' 155' ' ' ASN 0.25 0.2 OUTLIER -117.98 172.26 7.53 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 123.824 0.702 . . . . 52.149999999999999 111.376 162.795 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -120.89 141.77 50.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 114.522 -1.217 . . . . 56.530000000000001 111.144 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -162.88 131.81 4.08 Favored 'General case' 0 CA--C 1.476 -1.888 0 N-CA-C 106.391 -1.707 . . . . 52.049999999999997 106.391 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 50.81 35.63 12.64 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 113.707 1.002 . . . . 45.979999999999997 113.707 -178.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.17 19.92 77.67 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 119.924 -1.131 . . . . 42.18 113.818 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -127.1 169.76 13.07 Favored 'General case' 0 C--O 1.265 1.89 0 O-C-N 121.793 -0.828 . . . . 61.590000000000003 109.693 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -114.16 136.85 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.108 0 CA-C-N 114.425 -1.261 . . . . 37.890000000000001 109.579 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.7 mt -123.81 120.19 59.07 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.086 0 O-C-N 124.452 1.095 . . . . 43.229999999999997 108.091 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tt -92.31 129.45 38.25 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.658 -1.979 . . . . 49.109999999999999 105.658 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 97.4 t -129.81 121.76 53.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.193 -1.41 . . . . 31.489999999999998 107.193 -171.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -110.72 132.8 53.88 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.758 1.623 . . . . 28.890000000000001 108.261 173.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.4 t -122.37 127.63 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.958 0 C-N-CA 125.119 1.368 . . . . 29.27 108.083 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -84.66 112.91 20.89 Favored 'General case' 0 C--O 1.267 2.003 0 N-CA-C 106.247 -1.76 . . . . 30.539999999999999 106.247 173.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.93 -45.15 91.86 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.064 -1.055 . . . . 47.009999999999998 109.611 -158.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -32.83 71.98 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 115.53 1.678 . . . . 42.359999999999999 115.53 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 97.7 p -104.69 -26.09 12.43 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 119.674 1.124 . . . . 37.649999999999999 113.326 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.35 8.12 75.12 Favored Glycine 0 CA--C 1.55 2.27 0 O-C-N 121.607 -0.683 . . . . 30.280000000000001 111.407 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -71.99 138.45 48.0 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 109.202 -0.666 . . . . 34.460000000000001 109.202 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ILE . . . . . . . . . . . . . 26.0 pt -120.96 153.75 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 N-CA-C 116.04 1.866 . . . . 57.770000000000003 116.04 173.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . 0.761 ' OE1' ' NH1' ' A' ' 107' ' ' ARG . 72.0 mt-10 -128.37 148.58 50.7 Favored 'General case' 0 CA--C 1.472 -2.022 0 CA-C-N 113.522 -1.672 . . . . 35.659999999999997 107.818 161.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -151.7 154.95 37.33 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.899 -0.591 . . . . 35.969999999999999 111.065 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -143.74 147.76 34.68 Favored 'General case' 0 C--O 1.264 1.843 0 N-CA-C 104.901 -2.259 . . . . 50.18 104.901 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.25 128.76 41.97 Favored 'Isoleucine or valine' 0 C--O 1.267 2.007 0 N-CA-C 108.156 -1.053 . . . . 34.060000000000002 108.156 167.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 pt -120.86 153.32 57.1 Favored Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.446 1.091 . . . . 44.740000000000002 111.832 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -62.84 -59.86 0.21 Allowed 'Trans proline' 0 C--O 1.26 1.575 0 N-CA-C 107.445 -1.79 . . . . 63.810000000000002 107.445 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -122.42 143.95 49.35 Favored 'General case' 0 C--O 1.21 -1.014 0 O-C-N 125.193 1.558 . . . . 56.920000000000002 109.891 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.67 81.55 0.1 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 123.881 0.872 . . . . 55.939999999999998 110.611 164.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . 0.706 HG21 ' O ' ' A' ' 431' ' ' HOH . 0.6 OUTLIER -128.36 157.61 40.54 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 114.406 1.261 . . . . 61.229999999999997 114.406 -175.877 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.12 -43.65 83.56 Favored Glycine 0 C--O 1.212 -1.26 0 O-C-N 124.909 1.381 . . . . 37.840000000000003 111.946 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -58.09 -42.63 86.01 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 115.5 1.667 . . . . 63.969999999999999 115.5 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -71.69 -39.96 69.88 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.072 -1.085 . . . . 52.259999999999998 108.072 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.9 m -60.92 -44.62 96.93 Favored 'General case' 0 CA--C 1.562 1.437 0 CA-C-O 121.019 0.438 . . . . 28.07 110.194 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.43 -47.18 86.94 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.026 0.917 . . . . 25.25 110.94 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -62.5 -40.04 95.43 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 123.202 1.477 . . . . 32.700000000000003 110.582 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -65.52 -41.55 93.02 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 114.546 -1.206 . . . . 35.57 111.612 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.7 mt -61.05 -43.34 99.04 Favored 'General case' 0 C--O 1.188 -2.143 0 CA-C-N 115.536 -0.757 . . . . 32.079999999999998 111.72 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.6 -44.1 85.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.853 -0.529 . . . . 29.859999999999999 110.798 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.49 -47.96 76.99 Favored 'General case' 0 CA--C 1.48 -1.723 0 O-C-N 123.517 0.511 . . . . 58.039999999999999 111.469 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.8 tp -56.03 -48.85 75.2 Favored 'General case' 0 C--O 1.268 2.061 0 C-N-CA 120.079 -0.649 . . . . 28.77 111.635 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.67 -25.28 68.14 Favored 'General case' 0 C--O 1.204 -1.337 0 N-CA-C 112.626 0.602 . . . . 26.370000000000001 112.626 -172.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.96 81.0 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 121.844 -0.217 . . . . 26.940000000000001 113.622 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.761 ' NH1' ' OE1' ' A' ' 85' ' ' GLU . 60.9 mtt85 -98.16 -44.2 6.7 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 119.004 -0.522 . . . . 54.869999999999997 112.018 -178.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -120.9 161.35 40.68 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 109.265 -0.643 . . . . 30.440000000000001 109.265 -174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -83.94 88.86 1.04 Allowed 'Trans proline' 0 N--CA 1.485 0.995 0 N-CA-C 107.824 -1.645 . . . . 38.100000000000001 107.824 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 92.9 t -89.82 116.07 30.55 Favored 'Isoleucine or valine' 0 C--O 1.254 1.323 0 N-CA-C 107.286 -1.376 . . . . 33.0 107.286 -171.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . 0.412 ' CE ' ' O ' ' A' ' 475' ' ' HOH . 29.8 mmtp -104.4 -45.23 4.72 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 122.392 1.091 . . . . 71.459999999999994 110.778 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 39.1 p -139.09 147.07 41.51 Favored 'General case' 0 C--O 1.267 1.989 0 C-N-CA 118.998 -1.081 . . . . 40.369999999999997 112.003 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.8 t -125.86 135.53 63.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 113.818 -1.537 . . . . 33.350000000000001 111.726 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 413' ' ' HOH . 24.9 m170 -118.25 159.11 23.92 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 124.316 1.047 . . . . 76.230000000000004 110.298 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 8.8 t -149.81 158.81 44.53 Favored 'General case' 0 C--O 1.255 1.376 0 N-CA-C 107.221 -1.4 . . . . 32.659999999999997 107.221 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 474' ' ' HOH . 87.6 m-20 -87.78 -7.61 57.08 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 124.759 1.287 . . . . 55.390000000000001 110.534 175.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -131.34 94.87 3.64 Favored 'General case' 0 CA--C 1.482 -1.639 0 CA-C-N 118.688 0.676 . . . . 36.450000000000003 109.561 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.05 -29.4 68.06 Favored Glycine 0 C--O 1.265 2.085 0 CA-C-N 115.159 -0.928 . . . . 24.52 113.803 -172.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 28.9 p -61.97 -15.41 43.53 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 118.245 -1.382 . . . . 29.059999999999999 113.342 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -54.32 -33.4 58.8 Favored 'General case' 0 C--O 1.193 -1.878 0 O-C-N 121.124 -0.985 . . . . 34.619999999999997 112.63 174.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -105.3 25.2 10.93 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 114.108 1.151 . . . . 37.640000000000001 114.108 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' THR . . . . . 0.454 ' CG2' ' O ' ' A' ' 436' ' ' HOH . 0.3 OUTLIER -88.77 -29.13 20.01 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.024 -0.989 . . . . 45.780000000000001 112.506 -172.104 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . 0.402 ' OG ' HG23 ' A' ' 126' ' ' VAL . 64.5 p -62.99 154.11 31.62 Favored 'General case' 0 C--O 1.206 -1.185 0 O-C-N 119.997 -1.689 . . . . 40.0 113.632 -177.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 98.1 m -59.93 -32.86 71.18 Favored 'General case' 0 C--O 1.197 -1.68 0 CA-C-N 112.459 -2.155 . . . . 42.780000000000001 109.182 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.0 p -70.39 -43.99 68.93 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.4 -0.593 . . . . 35.460000000000001 109.4 -175.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' VAL . . . . . 0.402 HG23 ' OG ' ' A' ' 123' ' ' SER . 72.2 t -66.45 -45.83 88.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-O 121.971 0.891 . . . . 28.199999999999999 110.867 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -60.58 -39.39 87.91 Favored 'General case' 0 N--CA 1.428 -1.538 0 O-C-N 121.566 -0.709 . . . . 58.530000000000001 111.594 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.85 95.54 Favored 'General case' 0 CA--C 1.558 1.284 0 N-CA-C 112.783 0.66 . . . . 27.219999999999999 112.783 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.2 -47.87 78.08 Favored 'General case' 0 C--O 1.281 2.717 0 O-C-N 120.207 -1.558 . . . . 27.050000000000001 110.962 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.9 t90 -54.65 -53.42 55.07 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.731 0.641 . . . . 31.98 112.731 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 80.7 t90 -65.41 -37.67 87.65 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-O 123.006 1.384 . . . . 29.809999999999999 110.773 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.15 -2.89 58.87 Favored 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 120.56 -1.338 . . . . 30.649999999999999 113.474 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.12 38.76 39.11 Favored Glycine 0 C--O 1.206 -1.652 0 C-N-CA 119.974 -1.108 . . . . 31.190000000000001 113.909 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 83.4 mt -110.07 145.61 16.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.023 0 O-C-N 120.482 -1.599 . . . . 33.75 107.88 -175.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.61 160.65 17.65 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 114.338 1.236 . . . . 86.599999999999994 114.338 167.802 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 C--N 1.312 -1.042 0 O-C-N 120.671 -1.268 . . . . 57.299999999999997 112.873 172.918 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.175 0 CA-C-O 119.684 -0.198 . . . . 77.019999999999996 111.303 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASN . . . . . 0.513 HD21 HG23 ' A' ' 66' ' ' THR . 47.4 t-20 -34.74 -53.46 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.024 0.916 . . . . 99.950000000000003 113.006 174.983 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.15 -40.43 37.97 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 113.574 0.953 . . . . 112.66 113.574 -173.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.28 -47.08 87.51 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 122.245 1.021 . . . . 83.620000000000005 109.803 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 27.9 tp -62.37 -48.46 79.69 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 121.622 -0.674 . . . . 58.280000000000001 110.856 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -31.78 70.12 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.367 -0.933 . . . . 64.680000000000007 112.627 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.83 -56.3 18.66 Favored 'General case' 0 C--O 1.197 -1.699 0 N-CA-C 107.876 -1.157 . . . . 90.010000000000005 107.876 176.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 59.9 mt -57.95 -44.17 86.19 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 C-N-CA 120.414 -0.514 . . . . 45.329999999999998 111.609 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 57.2 mt -55.5 -46.41 78.83 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 N-CA-C 108.231 -1.026 . . . . 41.140000000000001 108.231 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -63.39 -38.95 97.2 Favored Glycine 0 N--CA 1.504 3.214 0 C-N-CA 119.316 -1.421 . . . . 43.719999999999999 112.223 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.42 -30.11 66.63 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 116.74 2.126 . . . . 52.359999999999999 116.74 170.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.3 m -109.08 -3.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.473 -2.006 0 CA-C-N 119.212 0.915 . . . . 43.140000000000001 111.251 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -60.26 -35.94 76.66 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 117.577 2.436 . . . . 45.380000000000003 117.577 -166.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -69.99 -19.03 63.35 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.454 -0.794 . . . . 81.670000000000002 110.673 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLN . . . . . 0.647 ' OE1' ' O ' ' A' ' 479' ' ' HOH . 28.5 mt-30 -85.01 -3.5 58.81 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 116.535 2.05 . . . . 55.979999999999997 116.535 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -129.41 151.15 50.36 Favored 'General case' 0 CA--C 1.483 -1.608 0 C-N-CA 116.979 -1.888 . . . . 48.969999999999999 107.403 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -75.54 -48.88 20.52 Favored 'General case' 0 N--CA 1.415 -2.188 0 O-C-N 124.143 0.902 . . . . 57.030000000000001 112.035 172.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -96.23 142.46 28.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.949 1.357 . . . . 44.039999999999999 110.886 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 64.2 tp -53.3 -39.14 63.77 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 114.917 -1.038 . . . . 36.780000000000001 110.596 175.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -66.83 -33.46 75.65 Favored 'General case' 0 C--O 1.248 0.994 0 O-C-N 120.399 -1.438 . . . . 41.409999999999997 108.323 -170.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.1 m -63.51 -48.52 77.23 Favored 'General case' 0 C--O 1.257 1.49 0 CA-C-O 122.24 1.019 . . . . 28.579999999999998 113.581 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.91 -40.45 73.09 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 114.182 1.179 . . . . 29.210000000000001 114.182 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.5 -45.74 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-O 121.579 0.704 . . . . 29.32 111.637 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 56.2 mm-40 -65.8 -38.34 88.7 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 117.419 -1.712 . . . . 31.670000000000002 111.76 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 92.2 mtp -55.23 -42.73 73.78 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 119.758 -0.777 . . . . 31.41 111.941 170.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -75.07 -31.48 61.24 Favored 'General case' 0 CA--C 1.488 -1.434 0 C-N-CA 118.759 -1.176 . . . . 28.18 112.32 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.0 t -63.6 -46.62 94.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.267 0 C-N-CA 118.097 -1.441 . . . . 26.789999999999999 111.674 173.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -52.94 -53.44 49.55 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 115.409 -0.814 . . . . 32.020000000000003 112.04 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 35.0 mt -59.52 -47.18 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 107.029 -1.471 . . . . 34.759999999999998 107.029 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -60.8 -47.13 87.73 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-O 122.142 0.972 . . . . 42.420000000000002 112.23 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -71.94 -28.03 63.18 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.062 -1.649 . . . . 31.350000000000001 113.193 -176.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -88.6 -25.94 22.19 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 114.096 1.147 . . . . 47.829999999999998 114.096 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -50.04 131.69 23.1 Favored 'General case' 0 C--O 1.204 -1.338 0 N-CA-C 113.162 0.801 . . . . 71.599999999999994 113.162 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -89.8 144.68 25.76 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.662 1.356 . . . . 86.280000000000001 114.662 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 188' ' ' LYS . . . . . 0.408 ' HZ3' ' N ' ' A' ' 194' ' ' TYR . 45.1 mttm . . . . . 0 N--CA 1.485 1.294 0 C-N-CA 127.1 2.16 . . . . 102.65000000000001 115.438 -172.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 194' ' ' TYR . . . . . 0.408 ' N ' ' HZ3' ' A' ' 188' ' ' LYS . 81.9 m-85 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 114.539 1.311 . . . . 100.06 114.539 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 99.9 p -88.42 159.65 17.91 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 107.239 -1.393 . . . . 37.810000000000002 107.239 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -53.14 -41.82 65.46 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 119.025 -1.07 . . . . 33.700000000000003 113.43 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.88 -34.13 86.11 Favored Glycine 0 C--O 1.269 2.339 0 O-C-N 119.927 -1.733 . . . . 33.0 113.933 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -77.32 -38.63 50.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 114.498 -0.851 . . . . 51.560000000000002 109.553 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 72.3 mtm-85 -61.59 -45.83 92.43 Favored 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 118.233 -1.387 . . . . 65.489999999999995 111.926 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 16.7 tt -57.57 -48.2 83.63 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 C-N-CA 117.717 -1.593 . . . . 36.969999999999999 111.209 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.95 -40.26 88.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 C-N-CA 119.154 -1.018 . . . . 49.630000000000003 108.525 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.32 -50.86 66.15 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 118.405 -1.318 . . . . 63.0 111.088 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 95.2 mt -52.95 -46.57 53.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 O-C-N 121.468 -0.77 . . . . 45.689999999999998 111.063 176.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 19.6 mm -72.5 -43.83 62.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.18 1.178 . . . . 51.460000000000001 114.18 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.4 79.25 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.72 0.295 . . . . 53.359999999999999 110.25 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 23.9 m -56.15 -37.9 70.13 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 115.721 -0.672 . . . . 60.719999999999999 111.22 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.42 -21.08 58.49 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 115.059 1.503 . . . . 70.200000000000003 115.059 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.484 1.24 0 CA-C-N 118.587 0.63 . . . . 79.590000000000003 112.598 -171.059 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' LF0 . . . . . 0.443 ' H17' ' C2 ' ' A' ' 301' ' ' LF0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . 0.495 ' O ' ' HB3' ' A' ' 114' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 409' ' ' HOH . . . . . 0.443 ' O ' ' CE2' ' A' ' 65' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 413' ' ' HOH . . . . . 0.525 ' O ' ' CD2' ' A' ' 114' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . 0.706 ' O ' HG21 ' A' ' 93' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 436' ' ' HOH . . . . . 0.454 ' O ' ' CG2' ' A' ' 122' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 473' ' ' HOH . . . . . 0.688 ' O ' ' NE ' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 474' ' ' HOH . . . . . 0.416 ' O ' ' HB2' ' A' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 475' ' ' HOH . . . . . 0.412 ' O ' ' CE ' ' A' ' 111' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 479' ' ' HOH . . . . . 0.647 ' O ' ' OE1' ' A' ' 168' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 483' ' ' HOH . . . . . 0.614 ' O ' ' N ' ' A' ' 57' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 489' ' ' HOH . . . . . 0.754 ' O ' ' HB3' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . 0.614 ' N ' ' O ' ' A' ' 483' ' ' HOH . 1.2 t . . . . . 0 N--CA 1.51 2.545 0 N-CA-C 112.642 0.608 . . . . 59.539999999999999 112.642 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.548 ' O ' ' HE1' ' A' ' 78' ' ' HIS . 37.4 Cg_endo -70.56 -16.4 34.18 Favored 'Trans proline' 0 N--CA 1.485 1.004 0 C-N-CA 123.295 2.663 . . . . 49.869999999999997 118.436 -160.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -99.73 6.65 58.91 Favored Glycine 0 N--CA 1.442 -0.912 0 CA-C-O 118.99 -0.894 . . . . 34.469999999999999 111.916 -173.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 54.8 mt -101.13 125.9 54.99 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 115.092 1.516 . . . . 47.530000000000001 115.092 -177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 70.6 m95 -123.7 149.8 45.07 Favored 'General case' 0 N--CA 1.439 -0.978 0 C-N-CA 125.78 1.632 . . . . 30.82 108.525 178.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -112.27 141.48 45.93 Favored 'General case' 0 N--CA 1.415 -2.191 0 C-N-CA 123.923 0.889 . . . . 40.740000000000002 110.901 165.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 10.6 tp -134.32 129.79 36.02 Favored 'General case' 0 C--O 1.256 1.425 0 N-CA-C 107.287 -1.375 . . . . 46.700000000000003 107.287 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -150.55 160.11 44.02 Favored 'General case' 0 CA--C 1.499 -1.01 0 C-N-CA 124.038 0.935 . . . . 38.289999999999999 109.013 175.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CAS . . . . . 0.443 ' CE2' ' O ' ' A' ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.513 HG23 HD21 ' A' ' 155' ' ' ASN 0.25 0.2 OUTLIER -117.98 172.26 7.53 Favored 'General case' 0 CA--C 1.494 -1.194 0 O-C-N 123.824 0.702 . . . . 52.149999999999999 111.376 162.795 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 62.8 m80 -120.89 141.77 50.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 114.522 -1.217 . . . . 56.530000000000001 111.144 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 12.7 tp -162.88 131.81 4.08 Favored 'General case' 0 CA--C 1.476 -1.888 0 N-CA-C 106.391 -1.707 . . . . 52.049999999999997 106.391 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 76.2 mt-10 50.81 35.63 12.64 Favored 'General case' 0 CA--C 1.499 -0.982 0 N-CA-C 113.707 1.002 . . . . 45.979999999999997 113.707 -178.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 71.17 19.92 77.67 Favored Glycine 0 N--CA 1.47 0.926 0 C-N-CA 119.924 -1.131 . . . . 42.18 113.818 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -127.1 169.76 13.07 Favored 'General case' 0 C--O 1.265 1.89 0 O-C-N 121.793 -0.828 . . . . 61.590000000000003 109.693 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 61.0 t -114.16 136.85 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.47 -2.108 0 CA-C-N 114.425 -1.261 . . . . 37.890000000000001 109.579 -175.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 71.7 mt -123.81 120.19 59.07 Favored 'Isoleucine or valine' 0 CA--C 1.471 -2.086 0 O-C-N 124.452 1.095 . . . . 43.229999999999997 108.091 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.9 tt -92.31 129.45 38.25 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 105.658 -1.979 . . . . 49.109999999999999 105.658 -178.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' VAL . . . . . . . . . . . . . 97.4 t -129.81 121.76 53.12 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 N-CA-C 107.193 -1.41 . . . . 31.489999999999998 107.193 -171.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -110.72 132.8 53.88 Favored 'General case' 0 C--O 1.268 2.046 0 C-N-CA 125.758 1.623 . . . . 28.890000000000001 108.261 173.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 59.4 t -122.37 127.63 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.958 0 C-N-CA 125.119 1.368 . . . . 29.27 108.083 -179.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . 0.548 ' HE1' ' O ' ' A' ' 58' ' ' PRO . 77.1 t60 -84.66 112.91 20.89 Favored 'General case' 0 C--O 1.267 2.003 0 N-CA-C 106.247 -1.76 . . . . 30.539999999999999 106.247 173.8 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 72.5 t -65.93 -45.15 91.86 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.064 -1.055 . . . . 47.009999999999998 109.611 -158.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.64 -32.83 71.98 Favored 'General case' 0 C--O 1.214 -0.787 0 N-CA-C 115.53 1.678 . . . . 42.359999999999999 115.53 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 0.542 ' OG ' ' HD2' ' A' ' 78' ' ' HIS . 97.7 p -104.69 -26.09 12.43 Favored 'General case' 0 N--CA 1.497 1.889 0 CA-C-N 119.674 1.124 . . . . 37.649999999999999 113.326 -172.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 87.35 8.12 75.12 Favored Glycine 0 CA--C 1.55 2.27 0 O-C-N 121.607 -0.683 . . . . 30.280000000000001 111.407 -174.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -71.99 138.45 48.0 Favored 'General case' 0 CA--C 1.487 -1.48 0 N-CA-C 109.202 -0.666 . . . . 34.460000000000001 109.202 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.681 ' H ' HD21 ' A' ' 184' ' ' ASN . 26.0 pt -120.96 153.75 24.39 Favored 'Isoleucine or valine' 0 N--CA 1.408 -2.543 0 N-CA-C 116.04 1.866 . . . . 57.770000000000003 116.04 173.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.761 ' OE1' ' NH1' ' A' ' 107' ' ' ARG . 72.0 mt-10 -128.37 148.58 50.7 Favored 'General case' 0 CA--C 1.472 -2.022 0 CA-C-N 113.522 -1.672 . . . . 35.659999999999997 107.818 161.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -151.7 154.95 37.33 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.899 -0.591 . . . . 35.969999999999999 111.065 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 56.9 mm-40 -143.74 147.76 34.68 Favored 'General case' 0 C--O 1.264 1.843 0 N-CA-C 104.901 -2.259 . . . . 50.18 104.901 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.25 128.76 41.97 Favored 'Isoleucine or valine' 0 C--O 1.267 2.007 0 N-CA-C 108.156 -1.053 . . . . 34.060000000000002 108.156 167.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 45.4 pt -120.86 153.32 57.1 Favored Pre-proline 0 N--CA 1.474 0.761 0 O-C-N 124.446 1.091 . . . . 44.740000000000002 111.832 -178.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_exo -62.84 -59.86 0.21 Allowed 'Trans proline' 0 C--O 1.26 1.575 0 N-CA-C 107.445 -1.79 . . . . 63.810000000000002 107.445 -178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -122.42 143.95 49.35 Favored 'General case' 0 C--O 1.21 -1.014 0 O-C-N 125.193 1.558 . . . . 56.920000000000002 109.891 -172.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -66.67 81.55 0.1 Allowed 'General case' 0 N--CA 1.437 -1.08 0 C-N-CA 123.881 0.872 . . . . 55.939999999999998 110.611 164.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . 0.706 HG21 ' O ' ' A' ' 431' ' ' HOH . 0.6 OUTLIER -128.36 157.61 40.54 Favored 'General case' 0 C--O 1.245 0.847 0 N-CA-C 114.406 1.261 . . . . 61.229999999999997 114.406 -175.877 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -55.12 -43.65 83.56 Favored Glycine 0 C--O 1.212 -1.26 0 O-C-N 124.909 1.381 . . . . 37.840000000000003 111.946 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -58.09 -42.63 86.01 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 115.5 1.667 . . . . 63.969999999999999 115.5 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 80.1 mm-40 -71.69 -39.96 69.88 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.072 -1.085 . . . . 52.259999999999998 108.072 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' THR . . . . . . . . . . . . . 90.9 m -60.92 -44.62 96.93 Favored 'General case' 0 CA--C 1.562 1.437 0 CA-C-O 121.019 0.438 . . . . 28.07 110.194 179.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -61.43 -47.18 86.94 Favored 'General case' 0 N--CA 1.483 1.217 0 CA-C-O 122.026 0.917 . . . . 25.25 110.94 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 55.5 t80 -62.5 -40.04 95.43 Favored 'General case' 0 CA--C 1.508 -0.647 0 CA-C-O 123.202 1.477 . . . . 32.700000000000003 110.582 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -65.52 -41.55 93.02 Favored 'General case' 0 C--O 1.25 1.129 0 CA-C-N 114.546 -1.206 . . . . 35.57 111.612 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 32.7 mt -61.05 -43.34 99.04 Favored 'General case' 0 C--O 1.188 -2.143 0 CA-C-N 115.536 -0.757 . . . . 32.079999999999998 111.72 178.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 73.6 mt -57.6 -44.1 85.19 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.853 -0.529 . . . . 29.859999999999999 110.798 178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -64.49 -47.96 76.99 Favored 'General case' 0 CA--C 1.48 -1.723 0 O-C-N 123.517 0.511 . . . . 58.039999999999999 111.469 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.8 tp -56.03 -48.85 75.2 Favored 'General case' 0 C--O 1.268 2.061 0 C-N-CA 120.079 -0.649 . . . . 28.77 111.635 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -63.67 -25.28 68.14 Favored 'General case' 0 C--O 1.204 -1.337 0 N-CA-C 112.626 0.602 . . . . 26.370000000000001 112.626 -172.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -77.27 -15.96 81.0 Favored Glycine 0 N--CA 1.47 0.929 0 C-N-CA 121.844 -0.217 . . . . 26.940000000000001 113.622 179.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.761 ' NH1' ' OE1' ' A' ' 85' ' ' GLU . 60.9 mtt85 -98.16 -44.2 6.7 Favored 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 119.004 -0.522 . . . . 54.869999999999997 112.018 -178.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 62.3 m95 -120.9 161.35 40.68 Favored Pre-proline 0 C--O 1.249 1.051 0 N-CA-C 109.265 -0.643 . . . . 30.440000000000001 109.265 -174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -83.94 88.86 1.04 Allowed 'Trans proline' 0 N--CA 1.485 0.995 0 N-CA-C 107.824 -1.645 . . . . 38.100000000000001 107.824 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 92.9 t -89.82 116.07 30.55 Favored 'Isoleucine or valine' 0 C--O 1.254 1.323 0 N-CA-C 107.286 -1.376 . . . . 33.0 107.286 -171.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.412 ' CE ' ' O ' ' A' ' 475' ' ' HOH . 29.8 mmtp -104.4 -45.23 4.72 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-O 122.392 1.091 . . . . 71.459999999999994 110.778 -177.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 39.1 p -139.09 147.07 41.51 Favored 'General case' 0 C--O 1.267 1.989 0 C-N-CA 118.998 -1.081 . . . . 40.369999999999997 112.003 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' VAL . . . . . . . . . . . . . 40.8 t -125.86 135.53 63.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.776 0 CA-C-N 113.818 -1.537 . . . . 33.350000000000001 111.726 179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . 0.525 ' CD2' ' O ' ' A' ' 413' ' ' HOH . 24.9 m170 -118.25 159.11 23.92 Favored 'General case' 0 CA--C 1.505 -0.776 0 C-N-CA 124.316 1.047 . . . . 76.230000000000004 110.298 176.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 8.8 t -149.81 158.81 44.53 Favored 'General case' 0 C--O 1.255 1.376 0 N-CA-C 107.221 -1.4 . . . . 32.659999999999997 107.221 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . 0.416 ' HB2' ' O ' ' A' ' 474' ' ' HOH . 87.6 m-20 -87.78 -7.61 57.08 Favored 'General case' 0 C--O 1.198 -1.621 0 O-C-N 124.759 1.287 . . . . 55.390000000000001 110.534 175.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 64.9 t-20 -131.34 94.87 3.64 Favored 'General case' 0 CA--C 1.482 -1.639 0 CA-C-N 118.688 0.676 . . . . 36.450000000000003 109.561 175.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -60.05 -29.4 68.06 Favored Glycine 0 C--O 1.265 2.085 0 CA-C-N 115.159 -0.928 . . . . 24.52 113.803 -172.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 28.9 p -61.97 -15.41 43.53 Favored 'General case' 0 CA--C 1.565 1.55 0 C-N-CA 118.245 -1.382 . . . . 29.059999999999999 113.342 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASN . . . . . . . . . . . . . 74.0 m-20 -54.32 -33.4 58.8 Favored 'General case' 0 C--O 1.193 -1.878 0 O-C-N 121.124 -0.985 . . . . 34.619999999999997 112.63 174.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -105.3 25.2 10.93 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 114.108 1.151 . . . . 37.640000000000001 114.108 -168.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' THR . . . . . 0.454 ' CG2' ' O ' ' A' ' 436' ' ' HOH . 0.3 OUTLIER -88.77 -29.13 20.01 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.024 -0.989 . . . . 45.780000000000001 112.506 -172.104 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . 0.402 ' OG ' HG23 ' A' ' 126' ' ' VAL . 64.5 p -62.99 154.11 31.62 Favored 'General case' 0 C--O 1.206 -1.185 0 O-C-N 119.997 -1.689 . . . . 40.0 113.632 -177.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' THR . . . . . . . . . . . . . 98.1 m -59.93 -32.86 71.18 Favored 'General case' 0 C--O 1.197 -1.68 0 CA-C-N 112.459 -2.155 . . . . 42.780000000000001 109.182 173.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' THR . . . . . . . . . . . . . 39.0 p -70.39 -43.99 68.93 Favored 'General case' 0 CA--C 1.501 -0.931 0 N-CA-C 109.4 -0.593 . . . . 35.460000000000001 109.4 -175.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.402 HG23 ' OG ' ' A' ' 123' ' ' SER . 72.2 t -66.45 -45.83 88.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.734 0 CA-C-O 121.971 0.891 . . . . 28.199999999999999 110.867 179.319 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . . . . . . . . . 78.7 mttt -60.58 -39.39 87.91 Favored 'General case' 0 N--CA 1.428 -1.538 0 O-C-N 121.566 -0.709 . . . . 58.530000000000001 111.594 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.85 95.54 Favored 'General case' 0 CA--C 1.558 1.284 0 N-CA-C 112.783 0.66 . . . . 27.219999999999999 112.783 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -64.2 -47.87 78.08 Favored 'General case' 0 C--O 1.281 2.717 0 O-C-N 120.207 -1.558 . . . . 27.050000000000001 110.962 175.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 50.9 t90 -54.65 -53.42 55.07 Favored 'General case' 0 N--CA 1.486 1.329 0 N-CA-C 112.731 0.641 . . . . 31.98 112.731 172.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' TRP . . . . . . . . . . . . . 80.7 t90 -65.41 -37.67 87.65 Favored 'General case' 0 C--O 1.248 1.015 0 CA-C-O 123.006 1.384 . . . . 29.809999999999999 110.773 -174.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ALA . . . . . . . . . . . . . . . -88.15 -2.89 58.87 Favored 'General case' 0 CA--C 1.493 -1.24 0 O-C-N 120.56 -1.338 . . . . 30.649999999999999 113.474 -175.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 75.12 38.76 39.11 Favored Glycine 0 C--O 1.206 -1.652 0 C-N-CA 119.974 -1.108 . . . . 31.190000000000001 113.909 -179.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ILE . . . . . . . . . . . . . 83.4 mt -110.07 145.61 16.39 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.023 0 O-C-N 120.482 -1.599 . . . . 33.75 107.88 -175.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -112.61 160.65 17.65 Favored 'General case' 0 N--CA 1.51 2.526 0 N-CA-C 114.338 1.236 . . . . 86.599999999999994 114.338 167.802 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 C--N 1.312 -1.042 0 O-C-N 120.671 -1.268 . . . . 57.299999999999997 112.873 172.918 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.175 0 CA-C-O 119.684 -0.198 . . . . 77.019999999999996 111.303 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASN . . . . . 0.513 HD21 HG23 ' A' ' 66' ' ' THR . 47.4 t-20 -34.74 -53.46 0.55 Allowed 'General case' 0 CA--C 1.562 1.417 0 CA-C-O 122.024 0.916 . . . . 99.950000000000003 113.006 174.983 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -78.15 -40.43 37.97 Favored 'General case' 0 C--O 1.22 -0.464 0 N-CA-C 113.574 0.953 . . . . 112.66 113.574 -173.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -60.28 -47.08 87.51 Favored 'General case' 0 CA--C 1.553 1.089 0 CA-C-O 122.245 1.021 . . . . 83.620000000000005 109.803 175.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 27.9 tp -62.37 -48.46 79.69 Favored 'General case' 0 CA--C 1.498 -1.055 0 O-C-N 121.622 -0.674 . . . . 58.280000000000001 110.856 178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -59.89 -31.78 70.12 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 119.367 -0.933 . . . . 64.680000000000007 112.627 176.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 28.2 ttmt -62.83 -56.3 18.66 Favored 'General case' 0 C--O 1.197 -1.699 0 N-CA-C 107.876 -1.157 . . . . 90.010000000000005 107.876 176.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ILE . . . . . . . . . . . . . 59.9 mt -57.95 -44.17 86.19 Favored 'Isoleucine or valine' 0 C--O 1.254 1.303 0 C-N-CA 120.414 -0.514 . . . . 45.329999999999998 111.609 178.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 57.2 mt -55.5 -46.41 78.83 Favored 'Isoleucine or valine' 0 C--O 1.268 2.057 0 N-CA-C 108.231 -1.026 . . . . 41.140000000000001 108.231 -179.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLY . . . . . . . . . . . . . . . -63.39 -38.95 97.2 Favored Glycine 0 N--CA 1.504 3.214 0 C-N-CA 119.316 -1.421 . . . . 43.719999999999999 112.223 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -58.42 -30.11 66.63 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 116.74 2.126 . . . . 52.359999999999999 116.74 170.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 33.3 m -109.08 -3.04 10.26 Favored 'Isoleucine or valine' 0 CA--C 1.473 -2.006 0 CA-C-N 119.212 0.915 . . . . 43.140000000000001 111.251 -172.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' ARG . . . . . . . . . . . . . 45.9 tpt85 -60.26 -35.94 76.66 Favored 'General case' 0 C--O 1.26 1.614 0 N-CA-C 117.577 2.436 . . . . 45.380000000000003 117.577 -166.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -69.99 -19.03 63.35 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.454 -0.794 . . . . 81.670000000000002 110.673 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLN . . . . . 0.647 ' OE1' ' O ' ' A' ' 479' ' ' HOH . 28.5 mt-30 -85.01 -3.5 58.81 Favored 'General case' 0 CA--C 1.486 -1.489 0 N-CA-C 116.535 2.05 . . . . 55.979999999999997 116.535 -179.2 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ALA . . . . . . . . . . . . . . . -129.41 151.15 50.36 Favored 'General case' 0 CA--C 1.483 -1.608 0 C-N-CA 116.979 -1.888 . . . . 48.969999999999999 107.403 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -75.54 -48.88 20.52 Favored 'General case' 0 N--CA 1.415 -2.188 0 O-C-N 124.143 0.902 . . . . 57.030000000000001 112.035 172.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -96.23 142.46 28.36 Favored 'General case' 0 CA--C 1.503 -0.844 0 CA-C-O 122.949 1.357 . . . . 44.039999999999999 110.886 -176.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' LEU . . . . . . . . . . . . . 64.2 tp -53.3 -39.14 63.77 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 114.917 -1.038 . . . . 36.780000000000001 110.596 175.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 50.0 pttt -66.83 -33.46 75.65 Favored 'General case' 0 C--O 1.248 0.994 0 O-C-N 120.399 -1.438 . . . . 41.409999999999997 108.323 -170.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' THR . . . . . . . . . . . . . 30.1 m -63.51 -48.52 77.23 Favored 'General case' 0 C--O 1.257 1.49 0 CA-C-O 122.24 1.019 . . . . 28.579999999999998 113.581 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ALA . . . . . . . . . . . . . . . -55.91 -40.45 73.09 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 114.182 1.179 . . . . 29.210000000000001 114.182 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 56.0 t -62.5 -45.74 98.07 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.373 0 CA-C-O 121.579 0.704 . . . . 29.32 111.637 174.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . 0.402 ' HA ' ' NE2' ' A' ' 177' ' ' GLN . 11.1 mm100 -65.8 -38.34 88.7 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 117.419 -1.712 . . . . 31.670000000000002 111.76 176.869 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' MET . . . . . . . . . . . . . 92.2 mtp -55.23 -42.73 73.78 Favored 'General case' 0 N--CA 1.512 2.641 0 C-N-CA 119.758 -0.777 . . . . 31.41 111.941 170.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -75.07 -31.48 61.24 Favored 'General case' 0 CA--C 1.488 -1.434 0 C-N-CA 118.759 -1.176 . . . . 28.18 112.32 -176.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' VAL . . . . . . . . . . . . . 55.0 t -63.6 -46.62 94.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.267 0 C-N-CA 118.097 -1.441 . . . . 26.789999999999999 111.674 173.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -52.94 -53.44 49.55 Favored 'General case' 0 N--CA 1.494 1.727 0 CA-C-N 115.409 -0.814 . . . . 32.020000000000003 112.04 175.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' ILE . . . . . . . . . . . . . 35.0 mt -59.52 -47.18 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.21 0 N-CA-C 107.029 -1.471 . . . . 34.759999999999998 107.029 -176.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HIS . . . . . . . . . . . . . 47.7 t60 -60.8 -47.13 87.73 Favored 'General case' 0 C--N 1.357 0.916 0 CA-C-O 122.142 0.972 . . . . 42.420000000000002 112.23 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ASN . . . . . 0.681 HD21 ' H ' ' A' ' 84' ' ' ILE . 9.3 m120 -71.94 -28.03 63.18 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.062 -1.649 . . . . 31.350000000000001 113.193 -176.665 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -88.6 -25.94 22.19 Favored 'General case' 0 N--CA 1.502 2.154 0 N-CA-C 114.096 1.147 . . . . 47.829999999999998 114.096 -177.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' LYS . . . . . . . . . . . . . 2.7 tppt? -50.04 131.69 23.1 Favored 'General case' 0 C--O 1.204 -1.338 0 N-CA-C 113.162 0.801 . . . . 71.599999999999994 113.162 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' ARG . . . . . . . . . . . . . 4.3 mtt85 -89.8 144.68 25.76 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.662 1.356 . . . . 86.280000000000001 114.662 177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' LYS . . . . . 0.408 ' HZ3' ' N ' ' A' ' 194' ' ' TYR . 45.1 mttm . . . . . 0 N--CA 1.485 1.294 0 C-N-CA 127.1 2.16 . . . . 102.65000000000001 115.438 -172.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' TYR . . . . . 0.408 ' N ' ' HZ3' ' A' ' 188' ' ' LYS . 81.9 m-85 . . . . . 0 N--CA 1.494 1.74 0 N-CA-C 114.539 1.311 . . . . 100.06 114.539 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' SER . . . . . . . . . . . . . 99.9 p -88.42 159.65 17.91 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 107.239 -1.393 . . . . 37.810000000000002 107.239 178.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' ALA . . . . . . . . . . . . . . . -53.14 -41.82 65.46 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 119.025 -1.07 . . . . 33.700000000000003 113.43 170.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' GLY . . . . . . . . . . . . . . . -60.88 -34.13 86.11 Favored Glycine 0 C--O 1.269 2.339 0 O-C-N 119.927 -1.733 . . . . 33.0 113.933 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' GLU . . . . . . . . . . . . . 73.1 mt-10 -77.32 -38.63 50.13 Favored 'General case' 0 CA--C 1.475 -1.921 0 CA-C-N 114.498 -0.851 . . . . 51.560000000000002 109.553 178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' ARG . . . . . . . . . . . . . 72.3 mtm-85 -61.59 -45.83 92.43 Favored 'General case' 0 N--CA 1.5 2.062 0 C-N-CA 118.233 -1.387 . . . . 65.489999999999995 111.926 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ILE . . . . . . . . . . . . . 16.7 tt -57.57 -48.2 83.63 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.165 0 C-N-CA 117.717 -1.593 . . . . 36.969999999999999 111.209 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' VAL . . . . . . . . . . . . . 2.4 t -64.95 -40.26 88.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.245 0 C-N-CA 119.154 -1.018 . . . . 49.630000000000003 108.525 -175.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -64.32 -50.86 66.15 Favored 'General case' 0 CA--C 1.56 1.353 0 C-N-CA 118.405 -1.318 . . . . 63.0 111.088 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ILE . . . . . . . . . . . . . 95.2 mt -52.95 -46.57 53.3 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 O-C-N 121.468 -0.77 . . . . 45.689999999999998 111.063 176.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ILE . . . . . . . . . . . . . 19.6 mm -72.5 -43.83 62.61 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.865 0 N-CA-C 114.18 1.178 . . . . 51.460000000000001 114.18 -177.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ALA . . . . . . . . . . . . . . . -57.44 -48.4 79.25 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.72 0.295 . . . . 53.359999999999999 110.25 175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' THR . . . . . . . . . . . . . 23.9 m -56.15 -37.9 70.13 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 115.721 -0.672 . . . . 60.719999999999999 111.22 177.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -75.42 -21.08 58.49 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 115.059 1.503 . . . . 70.200000000000003 115.059 -179.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ILE . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.484 1.24 0 CA-C-N 118.587 0.63 . . . . 79.590000000000003 112.598 -171.059 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' LF0 . . . . . 0.443 ' H17' ' C2 ' ' A' ' 301' ' ' LF0 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' ' MG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . 0.495 ' O ' ' HB3' ' A' ' 114' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 409' ' ' HOH . . . . . 0.443 ' O ' ' CE2' ' A' ' 65' ' ' CAS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 413' ' ' HOH . . . . . 0.525 ' O ' ' CD2' ' A' ' 114' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . 0.706 ' O ' HG21 ' A' ' 93' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 436' ' ' HOH . . . . . 0.454 ' O ' ' CG2' ' A' ' 122' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 460' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 461' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 462' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 464' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 465' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 466' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 467' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 468' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 469' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 470' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 471' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 472' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 473' ' ' HOH . . . . . 0.688 ' O ' ' NE ' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 474' ' ' HOH . . . . . 0.416 ' O ' ' HB2' ' A' ' 116' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 475' ' ' HOH . . . . . 0.412 ' O ' ' CE ' ' A' ' 111' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 476' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 477' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 478' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 479' ' ' HOH . . . . . 0.647 ' O ' ' OE1' ' A' ' 168' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 480' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 481' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 482' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 483' ' ' HOH . . . . . 0.614 ' O ' ' N ' ' A' ' 57' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 484' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 485' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 486' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 487' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 488' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 489' ' ' HOH . . . . . 0.754 ' O ' ' HB3' ' A' ' 107' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 490' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 491' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_