data_2fmb_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 2fmb _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 ' 1' ' ' VAL . . . . . 0.493 ' N ' ' O ' ' A' ' 387' ' ' HOH 0.389 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 104.5 -2.407 . . . . 33.859999999999999 104.5 . . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.7 m -111.59 131.96 54.89 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 125.638 1.836 . . . . 34.030000000000001 109.837 -175.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -109.56 123.13 48.91 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 103.793 -2.669 . . . . 29.199999999999999 103.793 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.8 0.41 57.04 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.706 1.373 . . . . 24.789999999999999 114.706 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.4 mt 70.72 15.74 6.91 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 118.356 2.725 . . . . 20.420000000000002 118.356 174.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -69.11 -31.18 69.7 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.026 -1.101 . . . . 42.409999999999997 108.026 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.1 mmpt? -127.03 167.6 15.7 Favored 'General case' 0 C--O 1.251 1.132 0 O-C-N 125.552 1.782 . . . . 61.950000000000003 106.717 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.5 mtt85 -64.13 138.53 97.44 Favored Pre-proline 0 C--O 1.253 1.269 0 C-N-CA 114.504 -2.879 . . . . 34.939999999999998 108.677 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -76.17 100.11 1.35 Allowed 'Trans proline' 0 C--N 1.309 -1.545 0 O-C-N 123.361 1.19 . . . . 17.609999999999999 109.786 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 42.4 p -121.44 154.76 36.13 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.691 -0.686 . . . . 22.600000000000001 110.349 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -154.88 163.07 40.82 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 116.775 -1.97 . . . . 22.59 106.059 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.2 mt -95.72 133.57 36.35 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-O 127.115 3.341 . . . . 26.539999999999999 107.929 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.44 157.17 43.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 O-C-N 116.788 -3.695 . . . . 22.899999999999999 104.17 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 45.3 mt -101.73 126.17 48.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 115.138 -2.625 . . . . 33.490000000000002 104.216 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.2 mt -115.06 121.92 68.08 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 106.129 -1.804 . . . . 26.050000000000001 106.129 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 67.8 m-20 48.47 47.39 20.25 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 121.858 2.117 . . . . 22.489999999999998 107.443 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . 0.271 4.7 m-20 63.68 20.78 12.4 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 118.608 2.818 . . . . 56.780000000000001 118.608 178.571 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 13.1 m -121.95 120.41 28.46 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-O 114.837 -2.506 . . . . 23.5 106.915 -178.112 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -75.51 126.33 9.57 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.625 2.217 . . . . 25.0 107.622 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 144.38 51.37 Favored 'General case' 0 C--N 1.36 1.024 0 CA-C-O 116.166 -1.873 . . . . 24.530000000000001 110.825 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.784 ' CB ' ' O ' ' A' ' 358' ' ' HOH . 5.6 t-20 -86.08 125.92 33.8 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 104.144 -2.539 . . . . 51.229999999999997 104.144 176.434 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.6 m -124.6 155.63 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 125.999 2.062 . . . . 18.09 110.724 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.9 tp -93.1 137.22 32.65 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 116.098 -1.906 . . . . 18.670000000000002 106.722 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 84.3 mt -99.41 114.7 27.77 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 102.982 -2.97 . . . . 16.870000000000001 102.982 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -122.83 99.82 6.58 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 111.209 -2.723 . . . . 23.640000000000001 117.857 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.2 p -67.77 -18.89 65.02 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 127.468 2.98 . . . . 15.82 111.239 -177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.32 4.76 75.75 Favored Glycine 0 C--N 1.313 -0.749 0 CA-C-O 114.945 -3.142 . . . . 15.84 111.095 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -113.1 125.17 54.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 124.081 3.941 . . . . 16.399999999999999 103.99 -177.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.43 -29.07 67.64 Favored 'General case' 0 C--N 1.357 0.895 0 CA-C-N 113.862 -1.517 . . . . 21.899999999999999 113.969 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.9 t -143.87 159.44 42.54 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 126.103 2.127 . . . . 32.0 109.366 -176.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.0 m -87.18 141.44 28.65 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 117.15 -1.405 . . . . 17.52 112.405 -176.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.8 t -137.11 127.36 39.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 O-C-N 126.296 2.248 . . . . 22.91 110.141 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . 0.448 7.8 tp -93.1 140.05 29.92 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 112.991 -1.913 . . . . 34.210000000000001 107.846 175.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 64.0 p -68.79 154.03 42.71 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 107.954 -1.128 . . . . 23.57 107.954 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.4 m -60.8 -35.61 76.92 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 116.755 -1.593 . . . . 30.93 111.23 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.12 85.7 Favored 'General case' 0 C--N 1.295 -1.764 0 C-N-CA 127.525 2.33 . . . . 25.449999999999999 105.974 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -65.01 -41.71 95.08 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 126.068 2.105 . . . . 27.699999999999999 113.049 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.01 -38.77 80.0 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 125.999 2.809 . . . . 32.909999999999997 109.094 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -72.3 -19.38 61.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 116.606 -3.809 . . . . 37.649999999999999 111.779 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.26 30.0 mtp180 -96.66 -4.94 40.04 Favored 'General case' 0 C--N 1.32 -0.696 0 O-C-N 119.364 -2.085 . . . . 67.329999999999998 112.508 178.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.0 mt -57.74 141.75 47.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 119.373 0.988 . . . . 25.120000000000001 110.681 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . 0.82 ' CB ' ' NZ ' ' A' ' 42' ' ' LYS . 1.1 mtpm? -66.53 -36.7 83.34 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 117.49 -1.243 . . . . 57.32 108.442 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -130.36 144.93 51.69 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-O 112.398 -3.668 . . . . 56.369999999999997 108.274 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.5 mtm-85 -133.92 144.47 48.86 Favored 'General case' 0 C--N 1.31 -1.118 1 O-C-N 131.727 5.642 . . . . 53.159999999999997 107.181 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.38 -173.94 28.54 Favored Glycine 0 CA--C 1.558 2.75 0 N-CA-C 104.372 -3.491 . . . . 27.620000000000001 104.372 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -61.38 159.85 11.87 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 126.089 1.7 . . . . 35.450000000000003 112.626 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.7 mttm -105.84 126.84 52.65 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 105.977 -1.86 . . . . 59.770000000000003 105.977 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -108.66 137.78 46.05 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 103.052 -2.944 . . . . 69.609999999999999 103.052 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -70.46 143.72 51.67 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 105.134 -2.173 . . . . 64.379999999999995 105.134 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -119.48 -177.28 16.32 Favored Glycine 0 CA--C 1.539 1.583 0 N-CA-C 104.739 -3.344 . . . . 28.859999999999999 104.739 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 82.8 p -118.79 36.21 4.51 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.683 2.105 . . . . 37.200000000000003 116.683 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.45 173.68 17.75 Favored Glycine 0 N--CA 1.408 -3.217 1 C-N-CA 131.401 4.334 . . . . 22.02 118.774 173.171 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 pt -140.81 162.6 22.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 111.528 -2.336 . . . . 28.920000000000002 105.193 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.7 158.08 21.69 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 109.697 -1.361 . . . . 20.02 109.697 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.06 -159.42 9.82 Favored Glycine 0 C--O 1.269 2.339 0 N-CA-C 104.558 -3.417 . . . . 21.289999999999999 104.558 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . 0.758 ' O ' ' O ' ' A' ' 351' ' ' HOH . 1.5 t -75.2 132.48 33.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 112.492 -1.854 . . . . 23.690000000000001 112.827 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.01 -35.7 4.71 Favored Glycine 0 C--O 1.245 0.806 0 N-CA-C 118.23 2.052 . . . . 28.399999999999999 118.23 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.03 -164.64 24.45 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 120.387 2.094 . . . . 24.09 109.561 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -96.42 154.84 17.04 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 112.302 -3.714 . . . . 33.240000000000002 112.314 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.373 0.3 OUTLIER -139.71 143.64 30.11 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 1 O-C-N 133.167 6.542 . . . . 37.600000000000001 104.329 -179.202 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -69.56 147.5 50.68 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 115.075 -0.966 . . . . 53.039999999999999 111.979 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.342 17.5 p -137.5 165.8 25.42 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 117.032 -1.867 . . . . 21.010000000000002 110.44 178.384 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -131.67 165.89 22.69 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 101.498 -3.519 . . . . 34.340000000000003 101.498 168.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.4 p -117.38 156.03 28.58 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 124.6 2.143 . . . . 31.629999999999999 107.002 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.1 t -149.68 142.34 15.75 Favored Pre-proline 0 N--CA 1.494 1.728 0 CA-C-N 113.283 -1.78 . . . . 21.379999999999999 108.668 -177.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.87 137.31 17.57 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.327 2.018 . . . . 24.48 109.301 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.7 160.76 21.33 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 CA-C-O 127.132 3.349 . . . . 20.41 108.314 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 45.7 m -119.86 124.36 45.89 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 118.212 -2.805 . . . . 28.73 105.02 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.42 133.62 59.93 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 CA-C-N 113.058 -1.883 . . . . 31.629999999999999 108.673 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -119.11 130.86 55.79 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 125.054 2.359 . . . . 27.0 107.959 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -173.82 153.22 2.14 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 118.195 -2.815 . . . . 32.130000000000003 105.034 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 19.3 mttt 48.62 33.89 4.56 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 126.917 2.636 . . . . 55.939999999999998 112.537 177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 61.66 15.8 48.74 Favored Glycine 0 C--O 1.246 0.884 0 CA-C-O 118.345 -1.253 . . . . 49.299999999999997 113.261 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 39.6 mtt85 -101.95 153.94 19.41 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 106.209 -1.775 . . . . 78.579999999999998 106.209 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HIS . . . . . 0.551 ' NE2' ' NZ ' ' A' ' 77' ' ' LYS . 23.7 t60 -121.36 100.62 7.14 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 101.144 -3.65 . . . . 46.890000000000001 101.144 179.687 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 mt -102.5 128.93 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 117.601 -1.64 . . . . 38.200000000000003 112.346 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . 0.551 ' NZ ' ' NE2' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -109.87 111.77 23.39 Favored 'General case' 0 N--CA 1.445 -0.716 0 O-C-N 125.724 1.89 . . . . 39.939999999999998 107.036 -178.825 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.1 t -152.37 -168.47 3.07 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 114.653 -2.819 . . . . 32.109999999999999 109.776 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -111.3 142.36 43.62 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 118.514 -2.616 . . . . 52.409999999999997 105.517 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' MET . . . . . . . . . . . . 0.263 73.3 mtp -129.74 149.11 51.63 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 104.02 -2.585 . . . . 27.780000000000001 104.02 175.813 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.44 157.95 24.75 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-O 126.641 3.115 . . . . 25.079999999999998 108.956 174.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.9 t -125.86 130.49 72.4 Favored 'Isoleucine or valine' 0 C--O 1.262 1.746 0 O-C-N 117.825 -3.047 . . . . 18.469999999999999 108.142 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -159.43 158.78 32.71 Favored 'General case' 0 CA--C 1.488 -1.412 0 O-C-N 125.753 1.908 . . . . 19.57 114.119 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -81.15 79.96 7.69 Favored 'General case' 0 C--N 1.369 1.415 0 O-C-N 118.215 -2.803 . . . . 37.380000000000003 110.297 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 30.1 pt -116.6 162.28 27.64 Favored Pre-proline 0 C--O 1.215 -0.717 0 O-C-N 127.785 3.178 . . . . 24.52 105.767 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PRO . . . . . 0.53 ' CG ' ' C49' ' A' ' 201' ' ' LP1 . 8.7 Cg_exo -67.19 -26.4 42.35 Favored 'Trans proline' 0 C--O 1.204 -1.216 0 N-CA-C 119.415 2.814 . . . . 30.239999999999998 119.415 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.32 159.67 4.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 O-C-N 126.085 2.116 . . . . 30.809999999999999 110.01 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 m -87.09 133.13 33.64 Favored 'General case' 0 C--O 1.247 0.952 0 N-CA-C 103.469 -2.789 . . . . 16.91 103.469 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.297 41.6 mt -121.85 136.34 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 1 O-C-N 130.741 5.026 . . . . 32.100000000000001 111.129 -176.86 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.96 116.13 30.49 Favored 'General case' 0 CA--C 1.562 1.438 0 N-CA-C 104.054 -2.572 . . . . 27.73 104.054 172.297 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.54 -166.85 33.68 Favored Glycine 0 C--N 1.308 -1.007 0 O-C-N 126.001 2.063 . . . . 15.74 110.445 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 42.9 mtm105 -59.33 -35.67 74.27 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 116.268 1.951 . . . . 20.739999999999998 116.268 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -58.07 -52.16 66.67 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 117.068 -1.444 . . . . 31.809999999999999 109.241 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.9 mt -78.48 -35.51 19.17 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 CA-C-O 126.606 3.098 . . . . 29.899999999999999 112.404 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 60.8 mt -55.66 -40.97 72.97 Favored 'General case' 0 CA--C 1.54 0.588 1 O-C-N 114.255 -5.278 . . . . 20.440000000000001 110.606 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -66.16 -44.19 84.8 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 117.877 -3.015 . . . . 52.700000000000003 106.162 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -61.21 -38.09 85.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 117.317 -1.325 . . . . 47.520000000000003 112.153 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.2 mt -81.98 -6.91 59.51 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 116.311 -1.804 . . . . 29.600000000000001 109.67 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 87.64 12.53 66.64 Favored Glycine 0 CA--C 1.495 -1.201 0 C-N-CA 117.959 -2.067 . . . . 26.640000000000001 116.548 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.95 149.15 46.98 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 124.353 2.025 . . . . 27.16 110.369 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -141.86 146.29 35.63 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 123.925 1.821 . . . . 63.979999999999997 109.86 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . 0.368 49.0 tp -107.97 129.59 55.1 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 116.582 -2.047 . . . . 22.969999999999999 107.106 176.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.6 t -115.35 128.28 72.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 O-C-N 123.921 0.763 . . . . 29.949999999999999 108.996 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.813 0 N-CA-C 104.769 -2.308 . . . . 46.630000000000003 104.769 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' LP1 . . . . . 0.53 ' C49' ' CG ' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . 0.758 ' O ' ' O ' ' A' ' 56' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . 0.784 ' O ' ' CB ' ' A' ' 21' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' HOH . . . . . 0.431 ' O ' ' CA ' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 369' ' ' HOH . . . . . 0.426 ' O ' ' CD ' ' A' ' 42' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 387' ' ' HOH . . . . . 0.493 ' O ' ' N ' ' A' ' 1' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 390' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.389 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 104.5 -2.407 . . . . 33.859999999999999 104.5 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.7 m -111.59 131.96 54.89 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 125.638 1.836 . . . . 34.030000000000001 109.837 -175.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -109.56 123.13 48.91 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 103.793 -2.669 . . . . 29.199999999999999 103.793 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.8 0.41 57.04 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.706 1.373 . . . . 24.789999999999999 114.706 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.4 mt 70.72 15.74 6.91 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 118.356 2.725 . . . . 20.420000000000002 118.356 174.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -69.11 -31.18 69.7 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.026 -1.101 . . . . 42.409999999999997 108.026 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HD2' ' O ' ' A' ' 390' ' ' HOH . 4.1 mmpt? -127.03 167.6 15.7 Favored 'General case' 0 C--O 1.251 1.132 0 O-C-N 125.552 1.782 . . . . 61.950000000000003 106.717 177.683 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.5 mtt85 -64.13 138.53 97.44 Favored Pre-proline 0 C--O 1.253 1.269 0 C-N-CA 114.504 -2.879 . . . . 34.939999999999998 108.677 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -76.17 100.11 1.35 Allowed 'Trans proline' 0 C--N 1.309 -1.545 0 O-C-N 123.361 1.19 . . . . 17.609999999999999 109.786 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 42.4 p -121.44 154.76 36.13 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.691 -0.686 . . . . 22.600000000000001 110.349 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -154.88 163.07 40.82 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 116.775 -1.97 . . . . 22.59 106.059 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.2 mt -95.72 133.57 36.35 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-O 127.115 3.341 . . . . 26.539999999999999 107.929 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.44 157.17 43.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 O-C-N 116.788 -3.695 . . . . 22.899999999999999 104.17 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 45.3 mt -101.73 126.17 48.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 115.138 -2.625 . . . . 33.490000000000002 104.216 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.2 mt -115.06 121.92 68.08 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 106.129 -1.804 . . . . 26.050000000000001 106.129 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . 0.549 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 67.8 m-20 48.47 47.39 20.25 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 121.858 2.117 . . . . 22.489999999999998 107.443 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 16' ' ' ASN 0.271 4.7 m-20 63.68 20.78 12.4 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 118.608 2.818 . . . . 56.780000000000001 118.608 178.571 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 13.1 m -121.95 120.41 28.46 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-O 114.837 -2.506 . . . . 23.5 106.915 -178.112 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -75.51 126.33 9.57 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.625 2.217 . . . . 25.0 107.622 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 144.38 51.37 Favored 'General case' 0 C--N 1.36 1.024 0 CA-C-O 116.166 -1.873 . . . . 24.530000000000001 110.825 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 1.076 ' HB2' ' O ' ' A' ' 358' ' ' HOH . 5.6 t-20 -86.08 125.92 33.8 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 104.144 -2.539 . . . . 51.229999999999997 104.144 176.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.6 m -124.6 155.63 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 125.999 2.062 . . . . 18.09 110.724 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.9 tp -93.1 137.22 32.65 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 116.098 -1.906 . . . . 18.670000000000002 106.722 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 84.3 mt -99.41 114.7 27.77 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 102.982 -2.97 . . . . 16.870000000000001 102.982 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -122.83 99.82 6.58 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 111.209 -2.723 . . . . 23.640000000000001 117.857 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.2 p -67.77 -18.89 65.02 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 127.468 2.98 . . . . 15.82 111.239 -177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.32 4.76 75.75 Favored Glycine 0 C--N 1.313 -0.749 0 CA-C-O 114.945 -3.142 . . . . 15.84 111.095 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . 0.555 ' HB1' H253 ' A' ' 201' ' ' LP1 . . . -113.1 125.17 54.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 124.081 3.941 . . . . 16.399999999999999 103.99 -177.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.43 -29.07 67.64 Favored 'General case' 0 C--N 1.357 0.895 0 CA-C-N 113.862 -1.517 . . . . 21.899999999999999 113.969 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.9 t -143.87 159.44 42.54 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 126.103 2.127 . . . . 32.0 109.366 -176.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.0 m -87.18 141.44 28.65 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 117.15 -1.405 . . . . 17.52 112.405 -176.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.8 t -137.11 127.36 39.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 O-C-N 126.296 2.248 . . . . 22.91 110.141 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . 0.448 7.8 tp -93.1 140.05 29.92 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 112.991 -1.913 . . . . 34.210000000000001 107.846 175.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 64.0 p -68.79 154.03 42.71 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 107.954 -1.128 . . . . 23.57 107.954 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.4 m -60.8 -35.61 76.92 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 116.755 -1.593 . . . . 30.93 111.23 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.12 85.7 Favored 'General case' 0 C--N 1.295 -1.764 0 C-N-CA 127.525 2.33 . . . . 25.449999999999999 105.974 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -65.01 -41.71 95.08 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 126.068 2.105 . . . . 27.699999999999999 113.049 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.01 -38.77 80.0 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 125.999 2.809 . . . . 32.909999999999997 109.094 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 97.7 m-20 -72.3 -19.38 61.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 116.606 -3.809 . . . . 37.649999999999999 111.779 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.26 30.0 mtp180 -96.66 -4.94 40.04 Favored 'General case' 0 C--N 1.32 -0.696 0 O-C-N 119.364 -2.085 . . . . 67.329999999999998 112.508 178.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.0 mt -57.74 141.75 47.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 119.373 0.988 . . . . 25.120000000000001 110.681 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 1.06 ' HB3' ' NZ ' ' A' ' 42' ' ' LYS . 1.1 mtpm? -66.53 -36.7 83.34 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 117.49 -1.243 . . . . 57.32 108.442 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -130.36 144.93 51.69 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-O 112.398 -3.668 . . . . 56.369999999999997 108.274 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.5 mtm-85 -133.92 144.47 48.86 Favored 'General case' 0 C--N 1.31 -1.118 1 O-C-N 131.727 5.642 . . . . 53.159999999999997 107.181 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.38 -173.94 28.54 Favored Glycine 0 CA--C 1.558 2.75 0 N-CA-C 104.372 -3.491 . . . . 27.620000000000001 104.372 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -61.38 159.85 11.87 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 126.089 1.7 . . . . 35.450000000000003 112.626 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.712 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.7 mttm -105.84 126.84 52.65 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 105.977 -1.86 . . . . 59.770000000000003 105.977 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -108.66 137.78 46.05 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 103.052 -2.944 . . . . 69.609999999999999 103.052 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -70.46 143.72 51.67 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 105.134 -2.173 . . . . 64.379999999999995 105.134 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -119.48 -177.28 16.32 Favored Glycine 0 CA--C 1.539 1.583 0 N-CA-C 104.739 -3.344 . . . . 28.859999999999999 104.739 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 82.8 p -118.79 36.21 4.51 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.683 2.105 . . . . 37.200000000000003 116.683 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.45 173.68 17.75 Favored Glycine 0 N--CA 1.408 -3.217 1 C-N-CA 131.401 4.334 . . . . 22.02 118.774 173.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 pt -140.81 162.6 22.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 111.528 -2.336 . . . . 28.920000000000002 105.193 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.7 158.08 21.69 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 109.697 -1.361 . . . . 20.02 109.697 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.06 -159.42 9.82 Favored Glycine 0 C--O 1.269 2.339 0 N-CA-C 104.558 -3.417 . . . . 21.289999999999999 104.558 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . 0.758 ' O ' ' O ' ' A' ' 351' ' ' HOH . 1.5 t -75.2 132.48 33.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 112.492 -1.854 . . . . 23.690000000000001 112.827 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.01 -35.7 4.71 Favored Glycine 0 C--O 1.245 0.806 0 N-CA-C 118.23 2.052 . . . . 28.399999999999999 118.23 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.03 -164.64 24.45 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 120.387 2.094 . . . . 24.09 109.561 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -96.42 154.84 17.04 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 112.302 -3.714 . . . . 33.240000000000002 112.314 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.373 0.3 OUTLIER -139.71 143.64 30.11 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 1 O-C-N 133.167 6.542 . . . . 37.600000000000001 104.329 -179.202 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -69.56 147.5 50.68 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 115.075 -0.966 . . . . 53.039999999999999 111.979 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.342 17.5 p -137.5 165.8 25.42 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 117.032 -1.867 . . . . 21.010000000000002 110.44 178.384 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . 0.712 ' CE1' ' HG2' ' A' ' 47' ' ' LYS . 44.5 p90 -131.67 165.89 22.69 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 101.498 -3.519 . . . . 34.340000000000003 101.498 168.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.4 p -117.38 156.03 28.58 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 124.6 2.143 . . . . 31.629999999999999 107.002 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.1 t -149.68 142.34 15.75 Favored Pre-proline 0 N--CA 1.494 1.728 0 CA-C-N 113.283 -1.78 . . . . 21.379999999999999 108.668 -177.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.87 137.31 17.57 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.327 2.018 . . . . 24.48 109.301 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.7 160.76 21.33 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 CA-C-O 127.132 3.349 . . . . 20.41 108.314 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 45.7 m -119.86 124.36 45.89 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 118.212 -2.805 . . . . 28.73 105.02 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.42 133.62 59.93 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 CA-C-N 113.058 -1.883 . . . . 31.629999999999999 108.673 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -119.11 130.86 55.79 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 125.054 2.359 . . . . 27.0 107.959 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -173.82 153.22 2.14 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 118.195 -2.815 . . . . 32.130000000000003 105.034 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . 0.43 ' HD3' ' NH1' ' A' ' 74' ' ' ARG . 19.3 mttt 48.62 33.89 4.56 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 126.917 2.636 . . . . 55.939999999999998 112.537 177.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 61.66 15.8 48.74 Favored Glycine 0 C--O 1.246 0.884 0 CA-C-O 118.345 -1.253 . . . . 49.299999999999997 113.261 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . 0.43 ' NH1' ' HD3' ' A' ' 72' ' ' LYS . 39.6 mtt85 -101.95 153.94 19.41 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 106.209 -1.775 . . . . 78.579999999999998 106.209 178.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HIS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' LYS . 23.7 t60 -121.36 100.62 7.14 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 101.144 -3.65 . . . . 47.240000000000002 101.144 179.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 mt -102.5 128.93 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 117.601 -1.64 . . . . 38.200000000000003 112.346 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -109.87 111.77 23.39 Favored 'General case' 0 N--CA 1.445 -0.716 0 O-C-N 125.724 1.89 . . . . 39.939999999999998 107.036 -178.825 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.1 t -152.37 -168.47 3.07 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 114.653 -2.819 . . . . 32.109999999999999 109.776 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -111.3 142.36 43.62 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 118.514 -2.616 . . . . 52.409999999999997 105.517 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' MET . . . . . . . . . . . . 0.263 73.3 mtp -129.74 149.11 51.63 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 104.02 -2.585 . . . . 27.780000000000001 104.02 175.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.44 157.95 24.75 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-O 126.641 3.115 . . . . 25.079999999999998 108.956 174.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.9 t -125.86 130.49 72.4 Favored 'Isoleucine or valine' 0 C--O 1.262 1.746 0 O-C-N 117.825 -3.047 . . . . 18.469999999999999 108.142 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -159.43 158.78 32.71 Favored 'General case' 0 CA--C 1.488 -1.412 0 O-C-N 125.753 1.908 . . . . 19.57 114.119 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -81.15 79.96 7.69 Favored 'General case' 0 C--N 1.369 1.415 0 O-C-N 118.215 -2.803 . . . . 37.380000000000003 110.297 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 86' ' ' PRO . 30.1 pt -116.6 162.28 27.64 Favored Pre-proline 0 C--O 1.215 -0.717 0 O-C-N 127.785 3.178 . . . . 24.52 105.767 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PRO . . . . . 0.783 ' HG2' ' C49' ' A' ' 201' ' ' LP1 . 8.7 Cg_exo -67.19 -26.4 42.35 Favored 'Trans proline' 0 C--O 1.204 -1.216 0 N-CA-C 119.415 2.814 . . . . 30.239999999999998 119.415 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.32 159.67 4.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 O-C-N 126.085 2.116 . . . . 30.809999999999999 110.01 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 m -87.09 133.13 33.64 Favored 'General case' 0 C--O 1.247 0.952 0 N-CA-C 103.469 -2.789 . . . . 16.91 103.469 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.297 41.6 mt -121.85 136.34 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 1 O-C-N 130.741 5.026 . . . . 32.100000000000001 111.129 -176.86 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.96 116.13 30.49 Favored 'General case' 0 CA--C 1.562 1.438 0 N-CA-C 104.054 -2.572 . . . . 27.73 104.054 172.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.54 -166.85 33.68 Favored Glycine 0 C--N 1.308 -1.007 0 O-C-N 126.001 2.063 . . . . 15.74 110.445 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 42.9 mtm105 -59.33 -35.67 74.27 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 116.268 1.951 . . . . 20.739999999999998 116.268 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -58.07 -52.16 66.67 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 117.068 -1.444 . . . . 31.809999999999999 109.241 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.9 mt -78.48 -35.51 19.17 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 CA-C-O 126.606 3.098 . . . . 29.899999999999999 112.404 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 60.8 mt -55.66 -40.97 72.97 Favored 'General case' 0 CA--C 1.54 0.588 1 O-C-N 114.255 -5.278 . . . . 20.440000000000001 110.606 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -66.16 -44.19 84.8 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 117.877 -3.015 . . . . 52.700000000000003 106.162 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -61.21 -38.09 85.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 117.317 -1.325 . . . . 47.520000000000003 112.153 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.2 mt -81.98 -6.91 59.51 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 116.311 -1.804 . . . . 29.600000000000001 109.67 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 87.64 12.53 66.64 Favored Glycine 0 CA--C 1.495 -1.201 0 C-N-CA 117.959 -2.067 . . . . 26.640000000000001 116.548 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.95 149.15 46.98 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 124.353 2.025 . . . . 27.16 110.369 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -141.86 146.29 35.63 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 123.925 1.821 . . . . 63.979999999999997 109.86 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . 0.368 49.0 tp -107.97 129.59 55.1 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 116.582 -2.047 . . . . 22.969999999999999 107.106 176.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.6 t -115.35 128.28 72.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 O-C-N 123.921 0.763 . . . . 29.949999999999999 108.996 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.813 0 N-CA-C 104.769 -2.308 . . . . 46.630000000000003 104.769 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' LP1 . . . . . 0.783 ' C49' ' HG2' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . 0.758 ' O ' ' O ' ' A' ' 56' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . 1.076 ' O ' ' HB2' ' A' ' 21' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 359' ' ' HOH . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 369' ' ' HOH . . . . . 0.559 ' O ' ' HE3' ' A' ' 42' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 387' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 390' ' ' HOH . . . . . 0.536 ' O ' ' HD2' ' A' ' 7' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . 0.389 0.6 OUTLIER . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 104.5 -2.407 . . . . 33.86 104.5 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 29.7 m -111.59 131.96 54.89 Favored 'General case' 0 C--N 1.3 -1.577 0 O-C-N 125.638 1.836 . . . . 34.03 109.837 -175.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -109.56 123.13 48.91 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 103.793 -2.669 . . . . 29.2 103.793 -179.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 40.0 p30 -89.8 0.41 57.04 Favored 'General case' 0 C--N 1.309 -1.182 0 N-CA-C 114.706 1.373 . . . . 24.79 114.706 -178.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 40.4 mt 70.72 15.74 6.91 Favored 'General case' 0 CA--C 1.503 -0.838 0 N-CA-C 118.356 2.725 . . . . 20.42 118.356 174.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -69.11 -31.18 69.7 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.026 -1.101 . . . . 42.41 108.026 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.536 ' HD2' ' O ' ' A' ' 390' ' ' HOH . 4.1 mmpt? -127.03 167.6 15.7 Favored 'General case' 0 C--O 1.251 1.132 0 O-C-N 125.552 1.782 . . . . 61.95 106.717 177.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 72.5 mtt85 -64.13 138.53 97.44 Favored Pre-proline 0 C--O 1.253 1.269 0 C-N-CA 114.504 -2.879 . . . . 34.94 108.677 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -76.17 100.11 1.35 Allowed 'Trans proline' 0 C--N 1.309 -1.545 0 O-C-N 123.361 1.19 . . . . 17.61 109.786 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 42.4 p -121.44 154.76 36.13 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.691 -0.686 . . . . 22.6 110.349 178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -154.88 163.07 40.82 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 116.775 -1.97 . . . . 22.59 106.059 178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 90.2 mt -95.72 133.57 36.35 Favored 'Isoleucine or valine' 0 C--O 1.257 1.45 0 CA-C-O 127.115 3.341 . . . . 26.54 107.929 175.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 27.7 m -131.44 157.17 43.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 O-C-N 116.788 -3.695 . . . . 22.9 104.17 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 45.3 mt -101.73 126.17 48.54 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 115.138 -2.625 . . . . 33.49 104.216 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.2 mt -115.06 121.92 68.08 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.16 0 N-CA-C 106.129 -1.804 . . . . 26.05 106.129 174.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.549 ' O ' ' HB2' ' A' ' 17' ' ' ASP . 67.8 m-20 48.47 47.39 20.25 Favored 'General case' 0 C--N 1.292 -1.934 0 CA-C-N 121.858 2.117 . . . . 22.49 107.443 179.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.549 ' HB2' ' O ' ' A' ' 16' ' ' ASN 0.271 4.7 m-20 63.68 20.78 12.4 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 118.608 2.818 . . . . 56.78 118.608 178.571 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 13.1 m -121.95 120.41 28.46 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-O 114.837 -2.506 . . . . 23.5 106.915 -178.112 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -75.51 126.33 9.57 Favored 'Trans proline' 0 C--N 1.306 -1.71 0 C-N-CA 122.625 2.217 . . . . 25.0 107.622 -179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 94.4 mt -130.46 144.38 51.37 Favored 'General case' 0 C--N 1.36 1.024 0 CA-C-O 116.166 -1.873 . . . . 24.53 110.825 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 1.076 ' HB2' ' O ' ' A' ' 358' ' ' HOH . 5.6 t-20 -86.08 125.92 33.8 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 104.144 -2.539 . . . . 51.23 104.144 176.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 33.6 m -124.6 155.63 32.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 125.999 2.062 . . . . 18.09 110.724 -177.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 57.9 tp -93.1 137.22 32.65 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-O 116.098 -1.906 . . . . 18.67 106.722 -179.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 84.3 mt -99.41 114.7 27.77 Favored 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 102.982 -2.97 . . . . 16.87 102.982 178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.3 t0 -122.83 99.82 6.58 Favored 'General case' 0 C--O 1.243 0.725 0 CA-C-N 111.209 -2.723 . . . . 23.64 117.857 -170.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 58.2 p -67.77 -18.89 65.02 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 127.468 2.98 . . . . 15.82 111.239 -177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -82.32 4.76 75.75 Favored Glycine 0 C--N 1.313 -0.749 0 CA-C-O 114.945 -3.142 . . . . 15.84 111.095 176.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.555 ' HB1' H253 ' A' ' 201' ' ' LP1 . . . -113.1 125.17 54.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 124.081 3.941 . . . . 16.4 103.99 -177.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 94.3 m-20 -68.43 -29.07 67.64 Favored 'General case' 0 C--N 1.357 0.895 0 CA-C-N 113.862 -1.517 . . . . 21.9 113.969 179.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 13.9 t -143.87 159.44 42.54 Favored 'General case' 0 C--N 1.32 -0.69 0 O-C-N 126.103 2.127 . . . . 32.0 109.366 -176.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 62.0 m -87.18 141.44 28.65 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-O 117.15 -1.405 . . . . 17.52 112.405 -176.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 22.8 t -137.11 127.36 39.12 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.684 0 O-C-N 126.296 2.248 . . . . 22.91 110.141 -178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . 0.448 7.8 tp -93.1 140.05 29.92 Favored 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 112.991 -1.913 . . . . 34.21 107.846 175.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 64.0 p -68.79 154.03 42.71 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 107.954 -1.128 . . . . 23.57 107.954 176.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 90.4 m -60.8 -35.61 76.92 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-O 116.755 -1.593 . . . . 30.93 111.23 -179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -62.3 -47.12 85.7 Favored 'General case' 0 C--N 1.295 -1.764 0 C-N-CA 127.525 2.33 . . . . 25.45 105.974 -177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HIS . . . . . . . . . . . . . 46.6 m170 -65.01 -41.71 95.08 Favored 'General case' 0 C--N 1.358 0.965 0 O-C-N 126.068 2.105 . . . . 27.7 113.049 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -59.01 -38.77 80.0 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 125.999 2.809 . . . . 32.91 109.094 -178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -72.3 -19.38 61.68 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 116.606 -3.809 . . . . 37.65 111.779 -179.941 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . 0.26 30.0 mtp180 -96.66 -4.94 40.04 Favored 'General case' 0 C--N 1.32 -0.696 0 O-C-N 119.364 -2.085 . . . . 67.33 112.508 178.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 47.0 mt -57.74 141.75 47.63 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 119.373 0.988 . . . . 25.12 110.681 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 1.06 ' NZ ' ' HB3' ' A' ' 42' ' ' LYS . 1.1 mtpm? -66.53 -36.7 83.34 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 117.49 -1.243 . . . . 57.32 108.442 177.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -130.36 144.93 51.69 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-O 112.398 -3.668 . . . . 56.37 108.274 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 25.5 mtm-85 -133.92 144.47 48.86 Favored 'General case' 0 C--N 1.31 -1.118 1 O-C-N 131.727 5.642 . . . . 53.16 107.181 178.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -101.38 -173.94 28.54 Favored Glycine 0 CA--C 1.558 2.75 0 N-CA-C 104.372 -3.491 . . . . 27.62 104.372 175.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . . . -61.38 159.85 11.87 Favored 'General case' 0 C--O 1.242 0.702 0 O-C-N 126.089 1.7 . . . . 35.45 112.626 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.712 ' HG2' ' CE1' ' A' ' 63' ' ' PHE . 1.7 mttm -105.84 126.84 52.65 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 105.977 -1.86 . . . . 59.77 105.977 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -108.66 137.78 46.05 Favored 'General case' 0 C--N 1.306 -1.305 0 N-CA-C 103.052 -2.944 . . . . 69.61 103.052 178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -70.46 143.72 51.67 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 105.134 -2.173 . . . . 64.38 105.134 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -119.48 -177.28 16.32 Favored Glycine 0 CA--C 1.539 1.583 0 N-CA-C 104.739 -3.344 . . . . 28.86 104.739 -179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 82.8 p -118.79 36.21 4.51 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.683 2.105 . . . . 37.2 116.683 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.45 173.68 17.75 Favored Glycine 0 N--CA 1.408 -3.217 1 C-N-CA 131.401 4.334 . . . . 22.02 118.774 173.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 pt -140.81 162.6 22.77 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 CA-C-N 111.528 -2.336 . . . . 28.92 105.193 177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.7 158.08 21.69 Favored Glycine 0 N--CA 1.443 -0.86 0 N-CA-C 109.697 -1.361 . . . . 20.02 109.697 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -160.06 -159.42 9.82 Favored Glycine 0 C--O 1.269 2.339 0 N-CA-C 104.558 -3.417 . . . . 21.29 104.558 -178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.758 ' O ' ' O ' ' A' ' 351' ' ' HOH . 1.5 t -75.2 132.48 33.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.522 0 CA-C-N 112.492 -1.854 . . . . 23.69 112.827 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 110.01 -35.7 4.71 Favored Glycine 0 C--O 1.245 0.806 0 N-CA-C 118.23 2.052 . . . . 28.4 118.23 -178.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 134.03 -164.64 24.45 Favored Glycine 0 CA--C 1.536 1.394 0 CA-C-N 120.387 2.094 . . . . 24.09 109.561 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 85.3 m-20 -96.42 154.84 17.04 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 112.302 -3.714 . . . . 33.24 112.314 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . 0.373 0.3 OUTLIER -139.71 143.64 30.11 Favored 'Isoleucine or valine' 0 C--N 1.351 0.671 1 O-C-N 133.167 6.542 . . . . 37.6 104.329 -179.202 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -69.56 147.5 50.68 Favored 'General case' 0 C--N 1.352 0.703 0 CA-C-N 115.075 -0.966 . . . . 53.04 111.979 179.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . 0.342 17.5 p -137.5 165.8 25.42 Favored 'General case' 0 C--N 1.31 -1.12 0 C-N-CA 117.032 -1.867 . . . . 21.01 110.44 178.384 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.712 ' CE1' ' HG2' ' A' ' 47' ' ' LYS . 44.5 p90 -131.67 165.89 22.69 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 101.498 -3.519 . . . . 34.34 101.498 168.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 60.4 p -117.38 156.03 28.58 Favored 'General case' 0 C--O 1.245 0.849 0 CA-C-O 124.6 2.143 . . . . 31.63 107.002 177.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 7.1 t -149.68 142.34 15.75 Favored Pre-proline 0 N--CA 1.494 1.728 0 CA-C-N 113.283 -1.78 . . . . 21.38 108.668 -177.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -76.87 137.31 17.57 Favored 'Trans proline' 0 C--O 1.244 0.786 0 C-N-CA 122.327 2.018 . . . . 24.48 109.301 -179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 34.6 m -141.7 160.76 21.33 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.422 0 CA-C-O 127.132 3.349 . . . . 20.41 108.314 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 45.7 m -119.86 124.36 45.89 Favored 'General case' 0 CA--C 1.544 0.742 0 O-C-N 118.212 -2.805 . . . . 28.73 105.02 172.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 5.1 mt -114.42 133.62 59.93 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.161 0 CA-C-N 113.058 -1.883 . . . . 31.63 108.673 179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . . . -119.11 130.86 55.79 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-O 125.054 2.359 . . . . 27.0 107.959 177.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.6 tptt -173.82 153.22 2.14 Favored 'General case' 0 CA--C 1.546 0.808 0 O-C-N 118.195 -2.815 . . . . 32.13 105.034 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.43 ' HD3' ' NH1' ' A' ' 74' ' ' ARG . 19.3 mttt 48.62 33.89 4.56 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 126.917 2.636 . . . . 55.94 112.537 177.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 61.66 15.8 48.74 Favored Glycine 0 C--O 1.246 0.884 0 CA-C-O 118.345 -1.253 . . . . 49.3 113.261 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.43 ' NH1' ' HD3' ' A' ' 72' ' ' LYS . 39.6 mtt85 -101.95 153.94 19.41 Favored 'General case' 0 CA--C 1.519 -0.22 0 N-CA-C 106.209 -1.775 . . . . 78.58 106.209 178.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 77' ' ' LYS . 23.7 t60 -121.36 100.62 7.14 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 101.144 -3.65 . . . . 47.24 101.144 179.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 10.7 mt -102.5 128.93 54.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 117.601 -1.64 . . . . 38.2 112.346 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.57 ' HD2' ' HD2' ' A' ' 75' ' ' HIS . 0.2 OUTLIER -109.87 111.77 23.39 Favored 'General case' 0 N--CA 1.445 -0.716 0 O-C-N 125.724 1.89 . . . . 39.94 107.036 -178.825 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 9.1 t -152.37 -168.47 3.07 Favored 'General case' 0 C--O 1.244 0.796 0 C-N-CA 114.653 -2.819 . . . . 32.11 109.776 -178.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.4 mtt180 -111.3 142.36 43.62 Favored 'General case' 0 C--N 1.318 -0.769 0 O-C-N 118.514 -2.616 . . . . 52.41 105.517 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' MET . . . . . . . . . . . . 0.263 73.3 mtp -129.74 149.11 51.63 Favored 'General case' 0 N--CA 1.433 -1.277 0 N-CA-C 104.02 -2.585 . . . . 27.78 104.02 175.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 83.3 mt -81.44 157.95 24.75 Favored 'General case' 0 C--O 1.254 1.312 0 CA-C-O 126.641 3.115 . . . . 25.08 108.956 174.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 43.9 t -125.86 130.49 72.4 Favored 'Isoleucine or valine' 0 C--O 1.262 1.746 0 O-C-N 117.825 -3.047 . . . . 18.47 108.142 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -159.43 158.78 32.71 Favored 'General case' 0 CA--C 1.488 -1.412 0 O-C-N 125.753 1.908 . . . . 19.57 114.119 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -81.15 79.96 7.69 Favored 'General case' 0 C--N 1.369 1.415 0 O-C-N 118.215 -2.803 . . . . 37.38 110.297 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.419 ' HB ' ' HD2' ' A' ' 86' ' ' PRO . 30.1 pt -116.6 162.28 27.64 Favored Pre-proline 0 C--O 1.215 -0.717 0 O-C-N 127.785 3.178 . . . . 24.52 105.767 179.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.783 ' HG2' ' C49' ' A' ' 201' ' ' LP1 . 8.7 Cg_exo -67.19 -26.4 42.35 Favored 'Trans proline' 0 C--O 1.204 -1.216 0 N-CA-C 119.415 2.814 . . . . 30.24 119.415 -175.623 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 10.6 p -150.32 159.67 4.79 Favored 'Isoleucine or valine' 0 C--O 1.241 0.619 0 O-C-N 126.085 2.116 . . . . 30.81 110.01 -177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 m -87.09 133.13 33.64 Favored 'General case' 0 C--O 1.247 0.952 0 N-CA-C 103.469 -2.789 . . . . 16.91 103.469 -178.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . 0.297 41.6 mt -121.85 136.34 59.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.97 1 O-C-N 130.741 5.026 . . . . 32.1 111.129 -176.86 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.96 116.13 30.49 Favored 'General case' 0 CA--C 1.562 1.438 0 N-CA-C 104.054 -2.572 . . . . 27.73 104.054 172.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.54 -166.85 33.68 Favored Glycine 0 C--N 1.308 -1.007 0 O-C-N 126.001 2.063 . . . . 15.74 110.445 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ARG . . . . . . . . . . . . . 42.9 mtm105 -59.33 -35.67 74.27 Favored 'General case' 0 C--O 1.261 1.685 0 N-CA-C 116.268 1.951 . . . . 20.74 116.268 -174.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 24.2 p-10 -58.07 -52.16 66.67 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-O 117.068 -1.444 . . . . 31.81 109.241 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 51.9 mt -78.48 -35.51 19.17 Favored 'Isoleucine or valine' 0 C--O 1.251 1.165 0 CA-C-O 126.606 3.098 . . . . 29.9 112.404 179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 60.8 mt -55.66 -40.97 72.97 Favored 'General case' 0 CA--C 1.54 0.588 1 O-C-N 114.255 -5.278 . . . . 20.44 110.606 178.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -66.16 -44.19 84.8 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 117.877 -3.015 . . . . 52.7 106.162 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -61.21 -38.09 85.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 117.317 -1.325 . . . . 47.52 112.153 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 69.2 mt -81.98 -6.91 59.51 Favored 'General case' 0 N--CA 1.433 -1.281 0 CA-C-O 116.311 -1.804 . . . . 29.6 109.67 -178.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 87.64 12.53 66.64 Favored Glycine 0 CA--C 1.495 -1.201 0 C-N-CA 117.959 -2.067 . . . . 26.64 116.548 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -70.95 149.15 46.98 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 124.353 2.025 . . . . 27.16 110.369 -178.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 3.3 ptpt -141.86 146.29 35.63 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 123.925 1.821 . . . . 63.98 109.86 179.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . 0.368 49.0 tp -107.97 129.59 55.1 Favored 'General case' 0 CA--C 1.563 1.464 0 C-N-CA 116.582 -2.047 . . . . 22.97 107.106 176.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 25.6 t -115.35 128.28 72.61 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 O-C-N 123.921 0.763 . . . . 29.95 108.996 -176.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.813 0 N-CA-C 104.769 -2.308 . . . . 46.63 104.769 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' LP1 . . . . . 0.783 ' C49' ' HG2' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . 0.758 ' O ' ' O ' ' A' ' 56' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . 1.076 ' O ' ' HB2' ' A' ' 21' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' HOH . . . . . 0.469 ' O ' ' HA ' ' A' ' 86' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 362' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 363' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 364' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 366' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 369' ' ' HOH . . . . . 0.559 ' O ' ' HE3' ' A' ' 42' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 370' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 371' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 372' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 373' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 374' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 375' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 376' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 377' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 378' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 380' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 381' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 382' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 383' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 384' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 385' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 386' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 387' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 388' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 389' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 390' ' ' HOH . . . . . 0.536 ' O ' ' HD2' ' A' ' 7' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 391' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 394' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 395' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 396' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 397' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 400' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 498' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 499' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_