data_2xcb_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 2xcb _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 ' 27' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.363 0 N-CA-C 112.933 0.716 . . . . 55.56 112.933 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 mt -93.75 -4.88 49.58 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.097 1.359 . . . . 53.2 113.25 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.9 136.79 33.81 Favored 'General case' 0 C--O 1.215 -0.733 0 O-C-N 121.067 -1.021 . . . . 73.85 112.509 -179.692 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.04 9.93 56.68 Favored Glycine 0 C--O 1.258 1.619 0 N-CA-C 115.853 1.101 . . . . 47.36 115.853 173.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.2 mt -63.87 148.14 50.14 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 114.391 1.256 . . . . 39.44 114.391 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.1 p -69.85 164.36 23.87 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 119.055 -1.058 . . . . 35.44 109.044 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -63.36 -36.09 82.57 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 124.224 0.952 . . . . 43.09 109.521 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -65.98 -36.06 82.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.057 -1.057 . . . . 46.06 112.577 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 95.7 m -69.61 -45.42 68.6 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 123.767 0.667 . . . . 31.55 111.906 172.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.4 mt -50.09 -43.77 51.59 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.186 1.55 . . . . 33.96 115.186 168.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.17 -42.68 95.5 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.688 -0.632 . . . . 39.7 112.389 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -69.11 -32.13 71.31 Favored 'General case' 0 C--O 1.261 1.683 0 C-N-CA 119.341 -0.944 . . . . 45.81 113.202 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 tp -71.6 -37.56 70.94 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.666 -0.814 . . . . 29.94 111.542 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.37 -45.89 91.92 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 119.775 -0.77 . . . . 26.59 111.939 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.31 62.6 Favored 'General case' 0 C--O 1.266 1.961 0 N-CA-C 114.264 1.209 . . . . 27.77 114.264 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.5 -46.54 79.31 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.57 -1.27 . . . . 39.25 107.57 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.83 -45.5 94.08 Favored Glycine 0 C--O 1.203 -1.841 0 O-C-N 124.062 0.851 . . . . 29.07 112.372 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -56.13 -41.67 75.7 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-N 117.371 0.586 . . . . 34.34 110.964 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -69.62 -41.18 76.01 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 119.919 -0.713 . . . . 39.37 111.937 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -60.32 -40.8 91.89 Favored 'General case' 0 C--O 1.263 1.765 0 O-C-N 123.811 0.694 . . . . 42.49 111.635 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -57.21 -51.43 69.35 Favored 'General case' 0 C--N 1.344 0.368 0 N-CA-C 113.08 0.77 . . . . 31.16 113.08 171.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -56.74 -28.81 61.78 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 112.508 0.558 . . . . 45.73 112.508 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -92.5 6.74 46.02 Favored 'General case' 0 CA--C 1.555 1.152 0 O-C-N 121.132 -0.98 . . . . 35.21 111.112 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.77 13.47 80.53 Favored Glycine 0 C--O 1.256 1.48 0 C-N-CA 119.522 -1.323 . . . . 32.19 113.052 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 26.8 mttp -88.29 76.49 8.37 Favored 'General case' 0 C--O 1.269 2.084 0 N-CA-C 108.306 -0.998 . . . . 36.36 108.306 175.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -70.3 -33.88 72.06 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 116.442 2.015 . . . . 43.67 116.442 -168.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -67.14 -39.15 86.52 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.078 0.77 . . . . 46.43 113.078 179.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 34.5 m-20 -73.06 -42.82 62.67 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.553 -1.203 . . . . 28.1 109.84 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.9 99.77 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.706 -0.85 . . . . 24.86 108.706 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -55.36 -44.33 75.88 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 118.167 -1.413 . . . . 26.52 112.525 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.17 -43.31 92.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.763 -0.653 . . . . 39.66 111.643 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.4 mm -60.35 -43.02 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.374 0 C-N-CA 118.724 -1.191 . . . . 30.97 112.387 175.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -70.03 -36.99 75.47 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 118.106 -1.438 . . . . 24.21 112.24 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.7 tp60 -60.32 -38.94 85.27 Favored 'General case' 0 N--CA 1.412 -2.366 0 N-CA-C 107.272 -1.381 . . . . 47.72 107.272 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.38 65.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 118.52 -1.272 . . . . 23.23 108.67 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.88 -44.38 91.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.331 1.604 . . . . 25.11 115.331 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.9 m -53.1 -31.51 42.39 Favored 'General case' 0 C--O 1.264 1.832 0 N-CA-C 114.048 1.129 . . . . 23.31 114.048 168.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 72.0 mtm -73.64 -41.21 63.06 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 113.988 1.107 . . . . 45.56 113.988 170.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.36 -31.15 65.35 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 114.216 1.191 . . . . 30.67 114.216 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -141.57 99.89 3.65 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 110.002 -0.37 . . . . 26.47 110.002 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . 0.409 ' CD2' ' O3 ' ' B' 1157 ' ' NO3 . 3.6 m-70 -71.65 -0.12 10.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.63 1.715 . . . . 30.6 115.63 -172.33 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -127.57 -7.02 5.72 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 114.218 1.192 . . . . 38.1 114.218 -167.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -84.42 101.4 11.98 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 107.757 -1.201 . . . . 27.96 107.757 -175.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.92 -33.94 39.46 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.926 1.084 . . . . 22.07 113.926 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -52.14 -38.6 58.09 Favored 'General case' 0 C--O 1.278 2.599 0 O-C-N 120.964 -1.085 . . . . 32.03 113.323 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -68.19 -31.75 71.5 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 119.468 -0.893 . . . . 25.04 110.298 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -81.59 -33.26 31.67 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 119.988 -0.685 . . . . 19.55 111.0 -175.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.3 tp -59.08 -51.44 70.03 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.166 1.386 . . . . 20.19 107.597 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.7 -48.96 78.05 Favored Glycine 0 N--CA 1.497 2.711 0 C-N-CA 120.873 -0.68 . . . . 18.26 113.987 177.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 35.6 tp -61.25 -52.76 63.4 Favored 'General case' 0 C--O 1.269 2.091 0 N-CA-C 106.576 -1.638 . . . . 18.63 106.576 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.1 -47.98 40.14 Favored Glycine 1 N--CA 1.529 4.874 0 C-N-CA 119.847 -1.168 . . . . 18.55 114.831 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.09 -38.78 92.54 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 117.926 0.863 . . . . 19.75 110.099 -176.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -63.92 -45.32 89.79 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 113.222 0.823 . . . . 23.79 113.222 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . 0.419 ' NH1' ' O ' ' A' 2016 ' ' HOH . 87.4 mtt180 -66.35 -41.35 89.65 Favored 'General case' 0 CA--C 1.563 1.449 0 O-C-N 124.336 1.023 . . . . 22.9 112.066 179.265 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -53.21 -49.15 67.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.247 -0.888 . . . . 23.79 111.717 172.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -66.22 -23.48 66.44 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.056 0.761 . . . . 31.38 113.056 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 78.0 mt -93.04 2.01 56.98 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.582 1.153 . . . . 28.54 113.185 175.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.7 15.69 80.37 Favored Glycine 0 CA--C 1.472 -2.613 0 C-N-CA 118.787 -1.673 . . . . 24.05 114.174 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.1 69.96 3.85 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 118.904 -1.118 . . . . 27.82 108.885 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' TYR . . . . . 0.5 ' CZ ' ' CG ' ' A' ' 116' ' ' GLN . 54.4 m-85 -65.59 -39.83 92.03 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.286 1.958 . . . . 27.16 116.286 -169.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -61.48 -45.06 95.84 Favored 'General case' 0 C--O 1.252 1.226 0 C-N-CA 120.475 -0.49 . . . . 30.52 110.193 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.5 -32.48 71.38 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.395 -0.922 . . . . 40.92 111.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.69 -41.1 98.17 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.548 -0.908 . . . . 19.37 108.548 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -62.6 -43.75 98.04 Favored 'General case' 0 CA--C 1.572 1.823 0 C-N-CA 117.715 -1.594 . . . . 20.45 110.519 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -54.82 -41.78 71.07 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 118.491 0.587 . . . . 33.69 111.781 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -71.1 -43.92 66.7 Favored 'General case' 0 C--O 1.279 2.638 0 CA-C-O 123.339 1.543 . . . . 24.09 114.183 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -61.26 -40.59 94.65 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.02 -1.445 . . . . 20.35 110.583 173.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.1 t -62.52 -44.72 95.66 Favored 'General case' 0 C--O 1.256 1.4 0 O-C-N 120.965 -1.085 . . . . 18.79 111.908 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.09 -45.59 76.82 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.433 -1.307 . . . . 22.46 111.596 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -51.04 -49.46 42.78 Favored Glycine 0 N--CA 1.432 -1.572 0 C-N-CA 118.807 -1.663 . . . . 20.35 113.494 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.28 63.1 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.661 -0.905 . . . . 20.95 111.321 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -32.41 73.85 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 113.371 0.878 . . . . 26.44 113.371 171.275 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 36.4 mmt -81.47 -27.77 34.44 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 113.223 0.823 . . . . 25.82 113.223 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -140.46 92.46 2.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.422 -1.325 . . . . 28.37 107.422 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 22.1 pt -66.07 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 113.838 1.051 . . . . 26.82 113.838 -173.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -91.61 -13.32 32.11 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.872 1.805 . . . . 29.28 115.872 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.36 114.09 42.15 Favored Pre-proline 0 C--O 1.259 1.584 0 CA-C-O 121.316 0.579 . . . . 29.05 111.804 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.25 -22.75 29.39 Favored 'Trans proline' 0 C--O 1.246 0.895 0 C-N-CA 123.757 2.972 . . . . 23.07 112.769 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -61.61 -36.74 81.59 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 113.706 1.002 . . . . 29.67 113.706 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -59.11 -59.61 13.27 Favored Pre-proline 0 C--O 1.211 -0.96 0 C-N-CA 120.015 -0.674 . . . . 25.61 111.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -71.73 -26.81 18.93 Favored 'Trans proline' 0 C--O 1.18 -2.389 0 C-N-CA 114.441 -3.239 . . . . 16.35 110.923 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.3 -55.49 24.3 Favored 'General case' 0 C--O 1.273 2.298 0 C-N-CA 119.597 -0.841 . . . . 22.57 111.056 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HIS . . . . . 0.482 ' NE2' ' OE1' ' C' ' 50' ' ' GLU . 91.3 m-70 -70.35 -28.46 65.15 Favored 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 118.081 -1.447 . . . . 22.23 111.814 -178.281 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.4 97.07 Favored 'General case' 0 CA--C 1.558 1.252 0 O-C-N 124.603 1.189 . . . . 17.52 109.492 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.17 -41.6 98.48 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.956 -1.02 . . . . 19.75 109.596 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -56.2 -41.34 75.43 Favored 'General case' 0 C--O 1.291 3.238 0 N-CA-C 115.609 1.707 . . . . 29.77 115.609 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.07 -43.18 83.28 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-O 117.436 -1.268 . . . . 20.98 107.59 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -59.48 -39.29 83.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 118.93 -1.108 . . . . 22.51 110.592 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.69 -47.86 81.81 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 115.415 -0.812 . . . . 28.52 109.785 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLN . . . . . 0.5 ' CG ' ' CZ ' ' A' ' 86' ' ' TYR . 77.4 mm-40 -61.05 -26.07 67.37 Favored 'General case' 0 C--O 1.253 1.267 0 C-N-CA 119.524 -0.87 . . . . 23.41 111.698 178.094 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.16 -1.32 57.94 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 119.655 -0.818 . . . . 28.91 112.397 174.646 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.73 20.75 63.01 Favored Glycine 0 C--O 1.261 1.794 0 C-N-CA 119.192 -1.48 . . . . 27.42 111.896 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -108.18 94.09 4.88 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 107.049 -1.463 . . . . 32.5 107.049 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 43.1 mt -71.67 -36.28 70.58 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 116.565 2.061 . . . . 35.87 116.565 -173.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -64.86 -44.61 89.16 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.144 -0.935 . . . . 34.84 111.585 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.61 -40.97 97.08 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 118.69 -1.719 . . . . 21.52 110.513 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.42 -42.29 71.8 Favored 'General case' 0 C--O 1.245 0.844 0 O-C-N 120.077 -1.837 . . . . 19.58 109.197 -174.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -56.71 -48.79 76.95 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.538 -0.756 . . . . 32.23 110.769 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.2 m -55.78 -47.74 76.54 Favored 'General case' 0 C--O 1.253 1.282 0 O-C-N 123.672 0.608 . . . . 24.24 110.291 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -64.19 -46.0 92.15 Favored Glycine 0 N--CA 1.497 2.758 0 C-N-CA 120.457 -0.878 . . . . 21.82 111.786 -174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -68.79 -38.15 79.78 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.185 -1.042 . . . . 24.0 108.185 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.73 -54.45 44.22 Favored 'General case' 0 C--O 1.281 2.757 0 N-CA-C 113.567 0.951 . . . . 24.84 113.567 171.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 74.8 m -55.64 -48.27 75.25 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.068 -0.515 . . . . 19.49 111.225 175.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.89 -39.51 89.55 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 123.636 0.585 . . . . 21.36 110.685 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -65.86 -43.12 89.35 Favored 'General case' 0 C--O 1.201 -1.465 0 C-N-CA 116.267 -2.173 . . . . 42.27 109.782 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.46 -45.81 92.35 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 120.701 -0.399 . . . . 24.37 111.17 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 80.6 mt -67.78 -43.46 79.7 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 119.634 -0.826 . . . . 26.74 109.534 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.34 -36.23 76.68 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 119.369 -0.932 . . . . 24.7 109.616 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.3 -29.22 67.45 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 113.703 1.001 . . . . 25.99 113.703 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.41 -1.92 43.44 Favored 'General case' 0 CA--C 1.563 1.452 0 N-CA-C 114.341 1.237 . . . . 31.42 114.341 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -135.54 118.23 12.49 Favored Pre-proline 0 N--CA 1.479 0.99 0 CA-C-N 118.743 0.701 . . . . 49.14 111.616 -171.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -59.33 -32.57 96.93 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 N-CA-C 115.921 1.469 . . . . 43.62 115.921 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -53.88 -25.4 19.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 114.005 1.113 . . . . 45.39 114.005 172.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -110.51 28.24 8.86 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.739 1.385 . . . . 48.62 114.739 -174.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . 0.51 ' CD ' ' O ' ' A' 2045 ' ' HOH . 38.0 tt0 -60.34 -39.56 87.56 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.283 1.957 . . . . 54.9 116.283 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.81 90.43 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.186 -0.946 . . . . 38.95 111.976 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 22.0 tp -66.12 -41.12 90.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.435 -0.793 . . . . 32.55 110.946 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.59 72.68 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 124.307 1.005 . . . . 30.23 110.14 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.46 91.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.197 0.443 . . . . 30.92 112.197 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ARG . . . . . 0.711 ' CD ' ' O ' ' A' 2047 ' ' HOH . 74.4 mtp180 -67.61 -40.99 84.68 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-O 118.539 -0.743 . . . . 36.87 111.408 176.589 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.45 -39.4 94.36 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.525 -0.917 . . . . 25.81 108.525 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -67.84 -43.36 83.8 Favored Glycine 0 N--CA 1.481 1.657 0 N-CA-C 108.739 -1.744 . . . . 27.0 108.739 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -61.26 -48.21 82.47 Favored 'General case' 0 C--O 1.266 1.956 0 CA-C-N 117.538 0.669 . . . . 27.23 112.6 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 94.7 mmm -62.27 -42.58 99.47 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 113.156 0.799 . . . . 30.37 113.156 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 65.6 tp -56.87 -46.64 81.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 118.764 -1.174 . . . . 28.8 111.894 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -59.05 -42.51 90.44 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.641 -0.709 . . . . 53.95 109.499 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.71 -45.28 94.64 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.654 -0.703 . . . . 28.21 110.401 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.54 -42.32 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 113.776 1.028 . . . . 27.54 113.776 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 96.2 m -60.65 -42.91 97.92 Favored 'General case' 0 C--O 1.262 1.754 0 O-C-N 121.776 -0.578 . . . . 33.0 109.576 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -53.84 -41.23 67.2 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 123.859 0.724 . . . . 29.57 112.735 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 -70.16 -37.92 75.33 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 111.389 0.144 . . . . 33.49 111.389 179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 31.8 mtpt -71.32 -31.87 67.93 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 118.433 -1.307 . . . . 36.54 109.71 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.343 0 N-CA-C 108.948 -0.76 . . . . 46.31 108.948 -178.807 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.182 0 N-CA-C 112.346 0.498 . . . . 63.59 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.19 -53.02 48.52 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 123.232 0.613 . . . . 62.92 111.725 172.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' MET . . . . . 0.446 ' SD ' ' C ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -74.81 -42.13 58.65 Favored 'General case' 0 C--O 1.254 1.302 0 C-N-CA 119.144 -1.022 . . . . 67.52 112.276 -175.357 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tp -70.65 3.83 2.87 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.104 0.962 . . . . 52.92 113.094 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.23 136.8 58.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 114.731 1.382 . . . . 63.27 114.731 175.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.37 25.88 38.12 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 118.077 1.991 . . . . 45.99 118.077 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LEU . . . . . . . . . . . . . 71.1 mt -67.86 153.08 44.49 Favored 'General case' 0 C--N 1.314 -0.959 0 O-C-N 121.427 -1.043 . . . . 40.92 111.61 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -68.04 167.93 12.95 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 109.13 -0.693 . . . . 41.82 109.13 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLU . . . . . 0.787 ' CA ' ' O ' ' B' 2002 ' ' HOH . 2.1 mt-10 -55.09 -48.03 74.12 Favored 'General case' 0 C--O 1.265 1.891 0 O-C-N 124.962 1.414 . . . . 46.44 112.07 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ASP . . . . . 0.738 ' OD2' ' OE2' ' B' ' 33' ' ' GLU . 15.8 t70 -67.6 -37.17 82.17 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.121 -0.945 . . . . 41.47 111.546 -174.726 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 24.3 m -67.87 -50.78 54.51 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.06 -0.719 . . . . 35.45 109.06 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . 0.514 ' CD1' ' O ' ' B' 2002 ' ' HOH . 63.9 mt -49.54 -46.23 48.42 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 123.948 0.78 . . . . 33.19 111.093 173.315 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -64.37 -41.77 96.53 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 118.858 -1.137 . . . . 39.57 112.856 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 64.8 mt-30 -65.21 -34.23 77.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.704 0.764 . . . . 43.88 109.232 177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 tp -69.06 -46.87 66.76 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.394 -0.965 . . . . 30.51 108.394 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -51.9 -49.63 62.64 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 115.171 -0.922 . . . . 47.68 108.97 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.52 -32.18 73.56 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 114.412 1.264 . . . . 31.45 114.412 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.02 -46.21 85.46 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.136 0.791 . . . . 39.56 113.136 170.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -51.98 -49.12 50.13 Favored Glycine 0 N--CA 1.472 1.048 0 CA-C-O 122.091 0.828 . . . . 31.9 113.246 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -60.8 -49.04 79.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 108.314 -0.995 . . . . 47.31 108.314 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -56.69 -42.31 78.88 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.207 -0.906 . . . . 49.89 111.984 -176.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -71.39 -31.7 67.58 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.03 0.381 . . . . 40.64 112.03 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -65.56 -55.67 16.48 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 108.023 -1.103 . . . . 42.63 108.023 174.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -51.52 -24.66 5.48 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 114.99 1.478 . . . . 47.49 114.99 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.65 -2.78 58.84 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.938 1.829 . . . . 44.81 115.938 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 89.19 -2.09 83.27 Favored Glycine 0 C--O 1.262 1.897 0 C-N-CA 119.232 -1.461 . . . . 44.23 114.653 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -86.2 77.7 9.51 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 122.722 1.249 . . . . 48.33 109.887 173.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -77.05 -36.78 55.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.352 -1.295 . . . . 42.0 114.191 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . 0.283 34.0 t0 -60.85 -48.34 82.25 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 114.657 -2.817 . . . . 32.56 111.977 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.83 -51.56 68.79 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.194 0.906 . . . . 39.93 109.68 170.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.05 -45.36 68.03 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 113.856 1.058 . . . . 27.62 113.856 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -51.62 -48.51 63.26 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.539 0.685 . . . . 37.48 111.251 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -66.71 -39.58 88.1 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 108.981 -0.748 . . . . 39.38 108.981 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.94 -48.22 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 C-N-CA 118.498 -1.281 . . . . 30.46 110.956 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.9 -42.16 98.76 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 118.805 -0.617 . . . . 27.6 111.985 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -53.57 -52.75 58.74 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.209 -0.997 . . . . 27.41 110.196 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.79 61.88 Favored 'General case' 0 C--O 1.215 -0.729 0 C-N-CA 120.315 -0.554 . . . . 27.7 111.094 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.1 mt -52.87 -42.15 64.99 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 114.324 1.231 . . . . 28.71 114.324 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 81.4 m -61.34 -32.1 71.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.591 0.589 . . . . 32.28 112.591 178.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 -39.83 16.0 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.622 1.169 . . . . 53.13 110.965 -176.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 53.3 mt -87.14 -38.38 16.48 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.15 0.5 . . . . 42.7 112.135 -169.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -96.16 169.24 10.09 Favored 'General case' 0 C--O 1.27 2.15 0 CA-C-O 121.35 0.595 . . . . 39.16 111.092 -174.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' HIS . . . . . 0.683 ' CD2' ' O ' ' B' 2014 ' ' HOH . 17.5 t60 -72.28 157.08 38.37 Favored 'General case' 0 C--O 1.252 1.189 0 N-CA-C 106.793 -1.558 . . . . 45.93 106.793 172.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' TYR . . . . . 1.017 ' CE2' ' O ' ' B' 2015 ' ' HOH . 77.6 t80 -42.67 132.82 3.63 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-N 115.067 -0.969 . . . . 40.71 112.422 -175.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -147.44 128.38 14.48 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-O 121.392 0.615 . . . . 41.08 111.249 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -46.52 -51.36 15.57 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.889 0.852 . . . . 36.96 110.888 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.05 -24.74 67.56 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 115.289 1.588 . . . . 48.25 115.289 -169.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 12.1 m-30 -68.23 -49.91 57.52 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.725 0.774 . . . . 31.2 111.431 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -72.0 -39.63 69.09 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 108.856 -0.794 . . . . 30.09 108.856 -175.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.64 -45.91 92.28 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.084 0.772 . . . . 33.47 113.084 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -50.91 61.53 Favored Glycine 0 N--CA 1.502 3.092 0 CA-C-O 119.556 -0.58 . . . . 28.88 112.598 174.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 tp -61.83 -44.59 96.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.583 0.957 . . . . 24.1 113.583 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.58 -44.16 96.95 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 108.074 -2.01 . . . . 27.25 108.074 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.94 -44.0 73.91 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.762 1.764 . . . . 33.25 115.762 173.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -60.03 -43.04 95.56 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.778 0.799 . . . . 34.44 113.031 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -68.25 -38.04 81.37 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.566 -0.743 . . . . 34.77 110.537 -172.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -59.93 -51.86 67.88 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.548 0.739 . . . . 39.41 110.962 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 49.3 m -54.16 -25.92 25.13 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.095 1.146 . . . . 38.5 114.095 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 9.6 mt -96.6 -0.1 49.15 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.095 1.517 . . . . 36.94 115.095 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.0 26.49 72.37 Favored Glycine 0 C--O 1.253 1.281 0 N-CA-C 111.374 -0.69 . . . . 35.52 111.374 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 mt -99.2 72.95 1.88 Allowed 'General case' 0 C--O 1.254 1.32 0 N-CA-C 103.928 -2.619 . . . . 35.09 103.928 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -76.4 -28.85 56.86 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.109 -0.95 . . . . 43.73 108.984 -167.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' GLU . . . . . 0.474 ' CG ' ' O ' ' B' 2018 ' ' HOH . 4.1 mm-40 -68.54 -47.38 67.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.286 -0.415 . . . . 39.61 111.564 176.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -68.03 -37.7 81.69 Favored 'General case' 0 CA--C 1.5 -0.952 0 O-C-N 122.99 0.181 . . . . 49.89 110.899 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.08 95.25 Favored 'General case' 0 C--O 1.245 0.863 0 C-N-CA 118.221 -1.392 . . . . 23.23 112.346 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 22.3 tp -54.78 -42.74 72.11 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 114.609 -1.178 . . . . 29.01 110.836 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -54.48 -52.27 62.44 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.988 -0.445 . . . . 37.86 110.927 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.1 m -55.41 -48.99 73.54 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.424 1.268 . . . . 25.86 114.424 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.89 -35.84 81.97 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 118.557 -0.735 . . . . 33.64 112.456 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 14.1 m -61.22 -48.32 82.02 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 118.565 -1.254 . . . . 21.34 113.001 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.02 -45.29 94.26 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 121.81 0.814 . . . . 27.51 111.624 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -49.88 -57.46 9.78 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 116.032 1.173 . . . . 25.57 116.032 172.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.6 -41.82 70.38 Favored 'General case' 0 C--O 1.265 1.878 0 C-N-CA 123.893 0.877 . . . . 26.6 111.193 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 tp -59.3 -40.47 86.31 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.059 -0.973 . . . . 28.96 112.754 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' MET . . . . . . . . . . . . . 10.3 mmt -94.14 -10.63 32.58 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.334 0.654 . . . . 37.05 112.556 -173.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -143.06 75.83 1.5 Allowed 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.519 -0.919 . . . . 40.92 108.519 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.45 -16.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 115.389 1.626 . . . . 35.77 115.389 -165.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . 0.276 61.1 m-20 -94.7 0.03 54.7 Favored 'General case' 0 C--O 1.275 2.43 0 N-CA-C 115.963 1.838 . . . . 34.0 115.963 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.36 109.88 18.37 Favored Pre-proline 0 N--CA 1.474 0.753 0 N-CA-C 112.997 0.74 . . . . 36.0 112.997 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -72.59 -20.44 23.37 Favored 'Trans proline' 0 CA--C 1.505 -0.949 0 N-CA-C 115.195 1.19 . . . . 31.4 115.195 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -68.44 -26.15 65.38 Favored 'General case' 0 C--O 1.177 -2.756 0 CA-C-O 117.671 -1.157 . . . . 42.74 113.672 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -64.02 -61.18 7.24 Favored Pre-proline 0 C--O 1.2 -1.549 0 N-CA-C 116.526 2.047 . . . . 26.78 116.526 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -58.63 -32.13 96.11 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 115.86 -2.293 . . . . 26.14 115.372 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -59.86 -52.86 63.64 Favored 'General case' 0 C--O 1.241 0.629 0 O-C-N 121.063 -1.023 . . . . 42.48 111.267 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -71.21 -30.49 66.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-O 118.546 -0.74 . . . . 34.04 111.587 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.3 86.88 Favored 'General case' 0 C--O 1.208 -1.081 0 N-CA-C 108.896 -0.779 . . . . 31.43 108.896 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.35 -47.6 81.48 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.868 -0.79 . . . . 36.58 108.868 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -47.13 -47.74 23.37 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.071 -0.966 . . . . 46.17 112.009 173.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.84 -36.16 81.7 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 115.406 1.632 . . . . 38.2 115.406 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -59.72 -38.97 83.15 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.776 -1.194 . . . . 36.16 107.776 176.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.0 mt -62.54 -57.88 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.455 0.702 . . . . 45.1 112.009 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -52.82 -30.34 32.88 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.295 -0.866 . . . . 47.0 112.061 171.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.48 4.35 28.21 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.515 -0.741 . . . . 47.18 111.266 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 52.0 43.3 55.5 Favored Glycine 0 N--CA 1.472 1.093 0 N-CA-C 116.859 1.504 . . . . 46.34 116.859 -169.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -116.46 87.56 2.71 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 105.712 -1.958 . . . . 49.75 105.712 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 2.9 mt -76.64 -27.44 55.66 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 118.338 -1.345 . . . . 48.05 111.573 -172.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -56.57 -48.16 77.97 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 119.785 1.175 . . . . 47.8 108.152 169.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.59 -45.37 96.45 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.237 0.336 . . . . 38.99 112.413 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.98 95.24 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-O 121.161 0.505 . . . . 35.91 110.296 -176.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -64.7 -48.83 73.25 Favored 'General case' 0 CA--C 1.504 -0.799 0 N-CA-C 107.614 -1.254 . . . . 52.8 107.614 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.3 m -54.04 -48.07 70.91 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.407 2.003 . . . . 36.16 116.407 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -67.42 -44.62 83.6 Favored Glycine 0 C--O 1.217 -0.966 0 N-CA-C 106.491 -2.644 . . . . 30.92 106.491 -175.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -66.25 -40.11 89.96 Favored 'General case' 0 N--CA 1.503 2.2 0 C-N-CA 118.64 -1.224 . . . . 38.08 110.967 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -60.34 -50.16 74.74 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 114.566 -1.197 . . . . 44.21 109.101 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 7.6 m -62.88 -41.39 99.39 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 119.312 -0.955 . . . . 33.95 111.272 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.37 89.9 Favored 'General case' 0 CA--C 1.478 -1.795 0 N-CA-C 107.684 -1.228 . . . . 33.08 107.684 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -58.33 -46.81 85.5 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 125.133 1.521 . . . . 47.9 111.818 -179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.69 91.97 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 114.966 1.469 . . . . 33.53 114.966 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.69 -47.39 72.56 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 116.017 -0.538 . . . . 34.0 111.524 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.73 98.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.827 0.851 . . . . 35.51 112.236 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.61 -29.0 67.68 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 112.532 0.568 . . . . 35.6 112.532 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -83.79 1.51 42.62 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 118.404 -1.318 . . . . 38.39 114.263 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 -127.12 117.09 21.86 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 113.758 1.021 . . . . 53.27 113.758 -174.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_exo -61.03 -39.47 59.95 Favored 'Trans proline' 0 N--CA 1.478 0.595 0 N-CA-C 113.428 0.511 . . . . 46.46 113.428 -172.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.22 -32.89 68.73 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 113.865 1.061 . . . . 50.92 113.865 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -98.7 28.71 4.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.875 -0.602 . . . . 53.98 112.247 -177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.13 -42.26 89.38 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 119.342 -0.943 . . . . 58.31 113.122 -171.3 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -55.16 -51.88 65.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.27 -0.877 . . . . 49.57 111.372 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 59.7 tp -51.89 -40.38 60.57 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.953 1.094 . . . . 48.5 113.953 -175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.53 -33.58 6.57 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 113.769 1.025 . . . . 51.03 113.769 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.65 -16.45 23.14 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 116.735 2.124 . . . . 52.89 116.735 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.27 -41.69 98.68 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 117.267 -1.773 . . . . 59.35 108.319 163.051 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.67 -53.5 46.42 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.565 0.746 . . . . 51.66 110.369 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . -47.09 -50.75 15.38 Favored Glycine 0 N--CA 1.475 1.286 0 O-C-N 124.644 1.215 . . . . 55.2 113.078 174.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.67 -42.89 81.4 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 117.92 0.86 . . . . 56.93 110.76 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 69.5 mmm -64.52 -36.54 84.53 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.245 -0.889 . . . . 62.73 111.936 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' LEU . . . . . . . . . . . . . 54.0 tp -56.83 -53.56 56.51 Favored 'General case' 0 CA--C 1.559 1.318 0 N-CA-C 112.872 0.693 . . . . 58.87 112.872 175.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 70.1 mt-10 -53.92 -40.76 66.98 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.686 0.995 . . . . 70.15 113.686 175.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -51.04 -53.9 29.48 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.479 -0.328 . . . . 64.3 111.845 170.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . . . -63.12 -50.31 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 114.139 1.163 . . . . 63.82 114.139 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 12.2 p -55.0 -13.53 1.16 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.322 1.23 . . . . 64.29 114.322 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.46 0 C-N-CA 122.811 0.444 . . . . 63.56 110.51 167.888 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.145 0 N-CA-C 109.168 -0.679 . . . . 37.4 109.168 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.44 137.39 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 119.22 0.918 . . . . 33.54 110.574 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' GLU . . . . . 0.764 ' CG ' ' O ' ' C' 2002 ' ' HOH . 1.1 pm0 -93.47 111.94 23.73 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.307 -1.368 . . . . 38.28 107.307 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 34.5 mt -81.89 150.12 27.93 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.868 1.062 . . . . 31.35 113.868 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.04 133.78 52.09 Favored 'General case' 0 N--CA 1.503 2.195 0 CA-C-O 117.831 -1.081 . . . . 37.45 110.638 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.63 143.64 98.23 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 106.584 -1.635 . . . . 33.94 106.584 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -72.53 -115.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.258 0 N-CA-C 115.193 1.19 . . . . 42.37 115.193 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ARG . . . . . 0.782 ' CG ' ' O ' ' C' 2001 ' ' HOH . 1.6 tpm_? . . . . . 0 N--CA 1.507 2.423 0 C-N-CA 125.594 1.558 . . . . 55.64 114.76 -171.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1157 ' ' NO3 . . . . . 0.409 ' O3 ' ' CD2' ' A' ' 67' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . 0.419 ' O ' ' NH1' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . 0.437 ' O ' ' NE2' ' A' ' 116' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2045 ' ' HOH . . . . . 0.51 ' O ' ' CD ' ' A' ' 141' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2047 ' ' HOH . . . . . 0.711 ' O ' ' CD ' ' A' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2002 ' ' HOH . . . . . 0.787 ' O ' ' CA ' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2003 ' ' HOH . . . . . 0.667 ' O ' ' CG ' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2014 ' ' HOH . . . . . 0.683 ' O ' ' CD2' ' B' ' 67' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2015 ' ' HOH . . . . . 1.017 ' O ' ' CE2' ' B' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2018 ' ' HOH . . . . . 0.474 ' O ' ' CG ' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2019 ' ' HOH . . . . . 0.456 ' O ' ' CD ' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2001 ' ' HOH . . . . . 0.782 ' O ' ' CG ' ' C' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 2002 ' ' HOH . . . . . 0.764 ' O ' ' CG ' ' C' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.363 0 N-CA-C 112.933 0.716 . . . . 55.560000000000002 112.933 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 mt -93.75 -4.88 49.58 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.097 1.359 . . . . 53.200000000000003 113.25 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -52.9 136.79 33.81 Favored 'General case' 0 C--O 1.215 -0.733 0 O-C-N 121.067 -1.021 . . . . 73.849999999999994 112.509 -179.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.04 9.93 56.68 Favored Glycine 0 C--O 1.258 1.619 0 N-CA-C 115.853 1.101 . . . . 47.359999999999999 115.853 173.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.2 mt -63.87 148.14 50.14 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 114.391 1.256 . . . . 39.439999999999998 114.391 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.1 p -69.85 164.36 23.87 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 119.055 -1.058 . . . . 35.439999999999998 109.044 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -63.36 -36.09 82.57 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 124.224 0.952 . . . . 43.090000000000003 109.521 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -65.98 -36.06 82.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.057 -1.057 . . . . 46.060000000000002 112.577 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 95.7 m -69.61 -45.42 68.6 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 123.767 0.667 . . . . 31.550000000000001 111.906 172.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.4 mt -50.09 -43.77 51.59 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.186 1.55 . . . . 33.960000000000001 115.186 168.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.17 -42.68 95.5 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.688 -0.632 . . . . 39.700000000000003 112.389 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -69.11 -32.13 71.31 Favored 'General case' 0 C--O 1.261 1.683 0 C-N-CA 119.341 -0.944 . . . . 45.810000000000002 113.202 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 tp -71.6 -37.56 70.94 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.666 -0.814 . . . . 29.940000000000001 111.542 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.37 -45.89 91.92 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 119.775 -0.77 . . . . 26.59 111.939 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.31 62.6 Favored 'General case' 0 C--O 1.266 1.961 0 N-CA-C 114.264 1.209 . . . . 27.77 114.264 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.5 -46.54 79.31 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.57 -1.27 . . . . 39.25 107.57 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.83 -45.5 94.08 Favored Glycine 0 C--O 1.203 -1.841 0 O-C-N 124.062 0.851 . . . . 29.07 112.372 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -56.13 -41.67 75.7 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-N 117.371 0.586 . . . . 34.340000000000003 110.964 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -69.62 -41.18 76.01 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 119.919 -0.713 . . . . 39.369999999999997 111.937 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 14.0 mm-40 -60.32 -40.8 91.89 Favored 'General case' 0 C--O 1.263 1.765 0 O-C-N 123.811 0.694 . . . . 42.490000000000002 111.635 173.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -57.21 -51.43 69.35 Favored 'General case' 0 C--N 1.344 0.368 0 N-CA-C 113.08 0.77 . . . . 31.16 113.08 171.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -56.74 -28.81 61.78 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 112.508 0.558 . . . . 45.729999999999997 112.508 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -92.5 6.74 46.02 Favored 'General case' 0 CA--C 1.555 1.152 0 O-C-N 121.132 -0.98 . . . . 35.210000000000001 111.112 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.77 13.47 80.53 Favored Glycine 0 C--O 1.256 1.48 0 C-N-CA 119.522 -1.323 . . . . 32.189999999999998 113.052 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . 0.649 ' HZ3' ' H ' ' A' ' 54' ' ' ASP . 26.8 mttp -88.29 76.49 8.37 Favored 'General case' 0 C--O 1.269 2.084 0 N-CA-C 108.306 -0.998 . . . . 36.359999999999999 108.306 175.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -70.3 -33.88 72.06 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 116.442 2.015 . . . . 43.670000000000002 116.442 -168.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.448 ' HB2' ' HZ1' ' A' ' 51' ' ' LYS . 0.6 OUTLIER -67.14 -39.15 86.52 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.078 0.77 . . . . 46.43 113.078 179.373 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . 0.649 ' H ' ' HZ3' ' A' ' 51' ' ' LYS . 34.5 m-20 -73.06 -42.82 62.67 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.553 -1.203 . . . . 28.100000000000001 109.84 179.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.9 99.77 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.706 -0.85 . . . . 24.859999999999999 108.706 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -55.36 -44.33 75.88 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 118.167 -1.413 . . . . 26.52 112.525 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.17 -43.31 92.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.763 -0.653 . . . . 39.659999999999997 111.643 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.4 mm -60.35 -43.02 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.374 0 C-N-CA 118.724 -1.191 . . . . 30.969999999999999 112.387 175.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -70.03 -36.99 75.47 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 118.106 -1.438 . . . . 24.210000000000001 112.24 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.7 tp60 -60.32 -38.94 85.27 Favored 'General case' 0 N--CA 1.412 -2.366 0 N-CA-C 107.272 -1.381 . . . . 47.719999999999999 107.272 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.38 65.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 118.52 -1.272 . . . . 23.23 108.67 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.88 -44.38 91.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.331 1.604 . . . . 25.109999999999999 115.331 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.9 m -53.1 -31.51 42.39 Favored 'General case' 0 C--O 1.264 1.832 0 N-CA-C 114.048 1.129 . . . . 23.309999999999999 114.048 168.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 72.0 mtm -73.64 -41.21 63.06 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 113.988 1.107 . . . . 45.560000000000002 113.988 170.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.36 -31.15 65.35 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 114.216 1.191 . . . . 30.670000000000002 114.216 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -141.57 99.89 3.65 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 110.002 -0.37 . . . . 26.469999999999999 110.002 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.65 -0.12 10.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.63 1.715 . . . . 30.600000000000001 115.63 -172.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -127.57 -7.02 5.72 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 114.218 1.192 . . . . 38.100000000000001 114.218 -167.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -84.42 101.4 11.98 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 107.757 -1.201 . . . . 27.960000000000001 107.757 -175.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.92 -33.94 39.46 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.926 1.084 . . . . 22.07 113.926 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -52.14 -38.6 58.09 Favored 'General case' 0 C--O 1.278 2.599 0 O-C-N 120.964 -1.085 . . . . 32.030000000000001 113.323 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -68.19 -31.75 71.5 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 119.468 -0.893 . . . . 25.039999999999999 110.298 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -81.59 -33.26 31.67 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 119.988 -0.685 . . . . 19.550000000000001 111.0 -175.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.3 tp -59.08 -51.44 70.03 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.166 1.386 . . . . 20.190000000000001 107.597 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.7 -48.96 78.05 Favored Glycine 0 N--CA 1.497 2.711 0 C-N-CA 120.873 -0.68 . . . . 18.260000000000002 113.987 177.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 35.6 tp -61.25 -52.76 63.4 Favored 'General case' 0 C--O 1.269 2.091 0 N-CA-C 106.576 -1.638 . . . . 18.629999999999999 106.576 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.1 -47.98 40.14 Favored Glycine 1 N--CA 1.529 4.874 0 C-N-CA 119.847 -1.168 . . . . 18.550000000000001 114.831 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.09 -38.78 92.54 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 117.926 0.863 . . . . 19.75 110.099 -176.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -63.92 -45.32 89.79 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 113.222 0.823 . . . . 23.789999999999999 113.222 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -66.35 -41.35 89.65 Favored 'General case' 0 CA--C 1.563 1.449 0 O-C-N 124.336 1.023 . . . . 22.899999999999999 112.066 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -53.21 -49.15 67.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.247 -0.888 . . . . 23.789999999999999 111.717 172.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -66.22 -23.48 66.44 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.056 0.761 . . . . 31.379999999999999 113.056 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 78.0 mt -93.04 2.01 56.98 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.582 1.153 . . . . 28.539999999999999 113.185 175.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.7 15.69 80.37 Favored Glycine 0 CA--C 1.472 -2.613 0 C-N-CA 118.787 -1.673 . . . . 24.050000000000001 114.174 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.1 69.96 3.85 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 118.904 -1.118 . . . . 27.82 108.885 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' TYR . . . . . 0.726 ' CZ ' ' HG2' ' A' ' 116' ' ' GLN . 54.4 m-85 -65.59 -39.83 92.03 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.286 1.958 . . . . 27.16 116.286 -169.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' 2020 ' ' HOH . 19.2 mm-40 -61.48 -45.06 95.84 Favored 'General case' 0 C--O 1.252 1.226 0 C-N-CA 120.475 -0.49 . . . . 30.52 110.193 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.5 -32.48 71.38 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.395 -0.922 . . . . 40.920000000000002 111.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.69 -41.1 98.17 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.548 -0.908 . . . . 19.370000000000001 108.548 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -62.6 -43.75 98.04 Favored 'General case' 0 CA--C 1.572 1.823 0 C-N-CA 117.715 -1.594 . . . . 20.449999999999999 110.519 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -54.82 -41.78 71.07 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 118.491 0.587 . . . . 33.689999999999998 111.781 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -71.1 -43.92 66.7 Favored 'General case' 0 C--O 1.279 2.638 0 CA-C-O 123.339 1.543 . . . . 24.09 114.183 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -61.26 -40.59 94.65 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.02 -1.445 . . . . 20.350000000000001 110.583 173.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.1 t -62.52 -44.72 95.66 Favored 'General case' 0 C--O 1.256 1.4 0 O-C-N 120.965 -1.085 . . . . 18.789999999999999 111.908 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.09 -45.59 76.82 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.433 -1.307 . . . . 22.460000000000001 111.596 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -51.04 -49.46 42.78 Favored Glycine 0 N--CA 1.432 -1.572 0 C-N-CA 118.807 -1.663 . . . . 20.350000000000001 113.494 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.28 63.1 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.661 -0.905 . . . . 20.949999999999999 111.321 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -32.41 73.85 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 113.371 0.878 . . . . 26.440000000000001 113.371 171.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 36.4 mmt -81.47 -27.77 34.44 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 113.223 0.823 . . . . 25.82 113.223 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -140.46 92.46 2.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.422 -1.325 . . . . 28.370000000000001 107.422 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 22.1 pt -66.07 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 113.838 1.051 . . . . 26.82 113.838 -173.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -91.61 -13.32 32.11 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.872 1.805 . . . . 29.280000000000001 115.872 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.36 114.09 42.15 Favored Pre-proline 0 C--O 1.259 1.584 0 CA-C-O 121.316 0.579 . . . . 29.050000000000001 111.804 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.25 -22.75 29.39 Favored 'Trans proline' 0 C--O 1.246 0.895 0 C-N-CA 123.757 2.972 . . . . 23.07 112.769 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -61.61 -36.74 81.59 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 113.706 1.002 . . . . 29.670000000000002 113.706 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -59.11 -59.61 13.27 Favored Pre-proline 0 C--O 1.211 -0.96 0 C-N-CA 120.015 -0.674 . . . . 25.609999999999999 111.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -71.73 -26.81 18.93 Favored 'Trans proline' 0 C--O 1.18 -2.389 0 C-N-CA 114.441 -3.239 . . . . 16.350000000000001 110.923 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.3 -55.49 24.3 Favored 'General case' 0 C--O 1.273 2.298 0 C-N-CA 119.597 -0.841 . . . . 22.57 111.056 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -70.35 -28.46 65.15 Favored 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 118.081 -1.447 . . . . 22.23 111.814 -178.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.4 97.07 Favored 'General case' 0 CA--C 1.558 1.252 0 O-C-N 124.603 1.189 . . . . 17.52 109.492 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.17 -41.6 98.48 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.956 -1.02 . . . . 19.75 109.596 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -56.2 -41.34 75.43 Favored 'General case' 0 C--O 1.291 3.238 0 N-CA-C 115.609 1.707 . . . . 29.77 115.609 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.07 -43.18 83.28 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-O 117.436 -1.268 . . . . 20.98 107.59 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -59.48 -39.29 83.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 118.93 -1.108 . . . . 22.510000000000002 110.592 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.69 -47.86 81.81 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 115.415 -0.812 . . . . 28.52 109.785 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLN . . . . . 0.726 ' HG2' ' CZ ' ' A' ' 86' ' ' TYR . 77.4 mm-40 -61.05 -26.07 67.37 Favored 'General case' 0 C--O 1.253 1.267 0 C-N-CA 119.524 -0.87 . . . . 23.41 111.698 178.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . 0.714 HD11 ' HB2' ' A' ' 86' ' ' TYR . 1.0 OUTLIER -88.16 -1.32 57.94 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 119.655 -0.818 . . . . 28.91 112.397 174.646 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.73 20.75 63.01 Favored Glycine 0 C--O 1.261 1.794 0 C-N-CA 119.192 -1.48 . . . . 27.420000000000002 111.896 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -108.18 94.09 4.88 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 107.049 -1.463 . . . . 32.5 107.049 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 43.1 mt -71.67 -36.28 70.58 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 116.565 2.061 . . . . 35.869999999999997 116.565 -173.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -64.86 -44.61 89.16 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.144 -0.935 . . . . 34.840000000000003 111.585 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.61 -40.97 97.08 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 118.69 -1.719 . . . . 21.52 110.513 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.42 -42.29 71.8 Favored 'General case' 0 C--O 1.245 0.844 0 O-C-N 120.077 -1.837 . . . . 19.579999999999998 109.197 -174.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -56.71 -48.79 76.95 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.538 -0.756 . . . . 32.229999999999997 110.769 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.2 m -55.78 -47.74 76.54 Favored 'General case' 0 C--O 1.253 1.282 0 O-C-N 123.672 0.608 . . . . 24.239999999999998 110.291 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -64.19 -46.0 92.15 Favored Glycine 0 N--CA 1.497 2.758 0 C-N-CA 120.457 -0.878 . . . . 21.82 111.786 -174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -68.79 -38.15 79.78 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.185 -1.042 . . . . 24.0 108.185 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.73 -54.45 44.22 Favored 'General case' 0 C--O 1.281 2.757 0 N-CA-C 113.567 0.951 . . . . 24.84 113.567 171.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 74.8 m -55.64 -48.27 75.25 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.068 -0.515 . . . . 19.489999999999998 111.225 175.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.89 -39.51 89.55 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 123.636 0.585 . . . . 21.359999999999999 110.685 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -65.86 -43.12 89.35 Favored 'General case' 0 C--O 1.201 -1.465 0 C-N-CA 116.267 -2.173 . . . . 42.270000000000003 109.782 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.46 -45.81 92.35 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 120.701 -0.399 . . . . 24.370000000000001 111.17 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 80.6 mt -67.78 -43.46 79.7 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 119.634 -0.826 . . . . 26.739999999999998 109.534 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.34 -36.23 76.68 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 119.369 -0.932 . . . . 24.699999999999999 109.616 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.3 -29.22 67.45 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 113.703 1.001 . . . . 25.989999999999998 113.703 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.41 -1.92 43.44 Favored 'General case' 0 CA--C 1.563 1.452 0 N-CA-C 114.341 1.237 . . . . 31.420000000000002 114.341 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -135.54 118.23 12.49 Favored Pre-proline 0 N--CA 1.479 0.99 0 CA-C-N 118.743 0.701 . . . . 49.140000000000001 111.616 -171.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -59.33 -32.57 96.93 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 N-CA-C 115.921 1.469 . . . . 43.619999999999997 115.921 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -53.88 -25.4 19.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 114.005 1.113 . . . . 45.390000000000001 114.005 172.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -110.51 28.24 8.86 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.739 1.385 . . . . 48.619999999999997 114.739 -174.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . 0.51 ' CD ' ' O ' ' A' 2045 ' ' HOH . 38.0 tt0 -60.34 -39.56 87.56 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.283 1.957 . . . . 54.899999999999999 116.283 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.81 90.43 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.186 -0.946 . . . . 38.950000000000003 111.976 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 22.0 tp -66.12 -41.12 90.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.435 -0.793 . . . . 32.549999999999997 110.946 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.59 72.68 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 124.307 1.005 . . . . 30.23 110.14 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.46 91.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.197 0.443 . . . . 30.920000000000002 112.197 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ARG . . . . . 0.711 ' CD ' ' O ' ' A' 2047 ' ' HOH . 74.4 mtp180 -67.61 -40.99 84.68 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-O 118.539 -0.743 . . . . 36.869999999999997 111.408 176.589 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.45 -39.4 94.36 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.525 -0.917 . . . . 25.809999999999999 108.525 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -67.84 -43.36 83.8 Favored Glycine 0 N--CA 1.481 1.657 0 N-CA-C 108.739 -1.744 . . . . 27.0 108.739 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -61.26 -48.21 82.47 Favored 'General case' 0 C--O 1.266 1.956 0 CA-C-N 117.538 0.669 . . . . 27.23 112.6 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 94.7 mmm -62.27 -42.58 99.47 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 113.156 0.799 . . . . 30.370000000000001 113.156 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 65.6 tp -56.87 -46.64 81.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 118.764 -1.174 . . . . 28.800000000000001 111.894 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -59.05 -42.51 90.44 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.641 -0.709 . . . . 53.950000000000003 109.499 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.71 -45.28 94.64 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.654 -0.703 . . . . 28.210000000000001 110.401 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.54 -42.32 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 113.776 1.028 . . . . 27.539999999999999 113.776 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 96.2 m -60.65 -42.91 97.92 Favored 'General case' 0 C--O 1.262 1.754 0 O-C-N 121.776 -0.578 . . . . 33.0 109.576 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -53.84 -41.23 67.2 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 123.859 0.724 . . . . 29.57 112.735 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 -70.16 -37.92 75.33 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 111.389 0.144 . . . . 33.490000000000002 111.389 179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 31.8 mtpt -71.32 -31.87 67.93 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 118.433 -1.307 . . . . 36.539999999999999 109.71 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.343 0 N-CA-C 108.948 -0.76 . . . . 46.310000000000002 108.948 -178.807 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.182 0 N-CA-C 112.346 0.498 . . . . 63.590000000000003 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . 0.633 ' O ' ' HG3' ' B' ' 29' ' ' ARG . . . -52.19 -53.02 48.52 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 123.232 0.613 . . . . 62.920000000000002 111.725 172.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -74.81 -42.13 58.65 Favored 'General case' 0 C--O 1.254 1.302 0 C-N-CA 119.144 -1.022 . . . . 67.519999999999996 112.276 -175.357 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tp -70.65 3.83 2.87 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.104 0.962 . . . . 52.920000000000002 113.094 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' B' ' 26' ' ' ALA . 0.5 OUTLIER -60.23 136.8 58.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 114.731 1.382 . . . . 63.270000000000003 114.731 175.427 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.37 25.88 38.12 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 118.077 1.991 . . . . 45.990000000000002 118.077 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LEU . . . . . 0.489 HD22 HG21 ' B' ' 35' ' ' THR . 71.1 mt -67.86 153.08 44.49 Favored 'General case' 0 C--N 1.314 -0.959 0 O-C-N 121.427 -1.043 . . . . 40.920000000000002 111.61 178.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -68.04 167.93 12.95 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 109.13 -0.693 . . . . 41.82 109.13 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLU . . . . . 1.158 ' HA ' ' O ' ' B' 2002 ' ' HOH . 2.1 mt-10 -55.09 -48.03 74.12 Favored 'General case' 0 C--O 1.265 1.891 0 O-C-N 124.962 1.414 . . . . 46.439999999999998 112.07 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ASP . . . . . 0.738 ' OD2' ' OE2' ' B' ' 33' ' ' GLU . 15.8 t70 -67.6 -37.17 82.17 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.121 -0.945 . . . . 41.469999999999999 111.546 -174.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' THR . . . . . 0.489 HG21 HD22 ' B' ' 31' ' ' LEU . 24.3 m -67.87 -50.78 54.51 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.06 -0.719 . . . . 35.450000000000003 109.06 -178.397 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . 0.879 HD12 ' O ' ' B' 2002 ' ' HOH . 63.9 mt -49.54 -46.23 48.42 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 123.948 0.78 . . . . 33.189999999999998 111.093 173.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -64.37 -41.77 96.53 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 118.858 -1.137 . . . . 39.57 112.856 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' B' ' 34' ' ' ASP . 18.4 mt-30 -65.21 -34.23 77.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.704 0.764 . . . . 43.880000000000003 109.232 177.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 tp -69.06 -46.87 66.76 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.394 -0.965 . . . . 30.510000000000002 108.394 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -51.9 -49.63 62.64 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 115.171 -0.922 . . . . 47.68 108.97 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.52 -32.18 73.56 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 114.412 1.264 . . . . 31.449999999999999 114.412 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.02 -46.21 85.46 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.136 0.791 . . . . 39.560000000000002 113.136 170.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -51.98 -49.12 50.13 Favored Glycine 0 N--CA 1.472 1.048 0 CA-C-O 122.091 0.828 . . . . 31.899999999999999 113.246 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -60.8 -49.04 79.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 108.314 -0.995 . . . . 47.310000000000002 108.314 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASN . . . . . 0.508 ' HB3' ' O ' ' B' 2007 ' ' HOH . 34.2 m-20 -56.69 -42.31 78.88 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.207 -0.906 . . . . 49.890000000000001 111.984 -176.622 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -71.39 -31.7 67.58 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.03 0.381 . . . . 40.640000000000001 112.03 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -65.56 -55.67 16.48 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 108.023 -1.103 . . . . 42.630000000000003 108.023 174.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -51.52 -24.66 5.48 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 114.99 1.478 . . . . 47.490000000000002 114.99 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.65 -2.78 58.84 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.938 1.829 . . . . 44.810000000000002 115.938 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 89.19 -2.09 83.27 Favored Glycine 0 C--O 1.262 1.897 0 C-N-CA 119.232 -1.461 . . . . 44.229999999999997 114.653 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' B' ' 51' ' ' LYS . 0.6 OUTLIER -86.2 77.7 9.51 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 122.722 1.249 . . . . 48.329999999999998 109.887 173.871 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -77.05 -36.78 55.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.352 -1.295 . . . . 42.0 114.191 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . 0.283 34.0 t0 -60.85 -48.34 82.25 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 114.657 -2.817 . . . . 32.560000000000002 111.977 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.83 -51.56 68.79 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.194 0.906 . . . . 39.93 109.68 170.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.05 -45.36 68.03 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 113.856 1.058 . . . . 27.620000000000001 113.856 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -51.62 -48.51 63.26 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.539 0.685 . . . . 37.479999999999997 111.251 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -66.71 -39.58 88.1 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 108.981 -0.748 . . . . 39.380000000000003 108.981 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.94 -48.22 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 C-N-CA 118.498 -1.281 . . . . 30.460000000000001 110.956 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.9 -42.16 98.76 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 118.805 -0.617 . . . . 27.600000000000001 111.985 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 28.0 tp60 -53.57 -52.75 58.74 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.209 -0.997 . . . . 27.41 110.196 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.79 61.88 Favored 'General case' 0 C--O 1.215 -0.729 0 C-N-CA 120.315 -0.554 . . . . 27.699999999999999 111.094 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.1 mt -52.87 -42.15 64.99 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 114.324 1.231 . . . . 28.710000000000001 114.324 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 81.4 m -61.34 -32.1 71.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.591 0.589 . . . . 32.280000000000001 112.591 178.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 -39.83 16.0 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.622 1.169 . . . . 53.130000000000003 110.965 -176.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 53.3 mt -87.14 -38.38 16.48 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.15 0.5 . . . . 42.700000000000003 112.135 -169.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ASP . . . . . 0.486 ' HB3' ' HE2' ' B' ' 72' ' ' TYR . 19.9 t0 -96.16 169.24 10.09 Favored 'General case' 0 C--O 1.27 2.15 0 CA-C-O 121.35 0.595 . . . . 39.159999999999997 111.092 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 17.5 t60 -72.28 157.08 38.37 Favored 'General case' 0 C--O 1.252 1.189 0 N-CA-C 106.793 -1.558 . . . . 45.93 106.793 172.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' TYR . . . . . 1.017 ' CE2' ' O ' ' B' 2015 ' ' HOH . 77.6 t80 -42.67 132.82 3.63 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-N 115.067 -0.969 . . . . 40.710000000000001 112.422 -175.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -147.44 128.38 14.48 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-O 121.392 0.615 . . . . 41.079999999999998 111.249 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -46.52 -51.36 15.57 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.889 0.852 . . . . 36.960000000000001 110.888 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.05 -24.74 67.56 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 115.289 1.588 . . . . 48.25 115.289 -169.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' B' ' 66' ' ' ASP . 12.1 m-30 -68.23 -49.91 57.52 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.725 0.774 . . . . 31.199999999999999 111.431 179.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -72.0 -39.63 69.09 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 108.856 -0.794 . . . . 30.09 108.856 -175.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.64 -45.91 92.28 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.084 0.772 . . . . 33.469999999999999 113.084 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -50.91 61.53 Favored Glycine 0 N--CA 1.502 3.092 0 CA-C-O 119.556 -0.58 . . . . 28.879999999999999 112.598 174.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 tp -61.83 -44.59 96.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.583 0.957 . . . . 24.100000000000001 113.583 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.58 -44.16 96.95 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 108.074 -2.01 . . . . 27.25 108.074 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.94 -44.0 73.91 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.762 1.764 . . . . 33.25 115.762 173.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -60.03 -43.04 95.56 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.778 0.799 . . . . 34.439999999999998 113.031 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . . . . . . . . . 65.4 mtt180 -68.25 -38.04 81.37 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.566 -0.743 . . . . 34.770000000000003 110.537 -172.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -59.93 -51.86 67.88 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.548 0.739 . . . . 39.409999999999997 110.962 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 49.3 m -54.16 -25.92 25.13 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.095 1.146 . . . . 38.5 114.095 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 9.6 mt -96.6 -0.1 49.15 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.095 1.517 . . . . 36.939999999999998 115.095 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.0 26.49 72.37 Favored Glycine 0 C--O 1.253 1.281 0 N-CA-C 111.374 -0.69 . . . . 35.520000000000003 111.374 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 mt -99.2 72.95 1.88 Allowed 'General case' 0 C--O 1.254 1.32 0 N-CA-C 103.928 -2.619 . . . . 35.090000000000003 103.928 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -76.4 -28.85 56.86 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.109 -0.95 . . . . 43.729999999999997 108.984 -167.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' B' 2018 ' ' HOH . 4.1 mm-40 -68.54 -47.38 67.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.286 -0.415 . . . . 39.609999999999999 111.564 176.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -68.03 -37.7 81.69 Favored 'General case' 0 CA--C 1.5 -0.952 0 O-C-N 122.99 0.181 . . . . 49.890000000000001 110.899 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.08 95.25 Favored 'General case' 0 C--O 1.245 0.863 0 C-N-CA 118.221 -1.392 . . . . 23.23 112.346 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 22.3 tp -54.78 -42.74 72.11 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 114.609 -1.178 . . . . 29.010000000000002 110.836 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -54.48 -52.27 62.44 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.988 -0.445 . . . . 37.859999999999999 110.927 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.1 m -55.41 -48.99 73.54 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.424 1.268 . . . . 25.859999999999999 114.424 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.89 -35.84 81.97 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 118.557 -0.735 . . . . 33.640000000000001 112.456 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 14.1 m -61.22 -48.32 82.02 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 118.565 -1.254 . . . . 26.129999999999999 113.001 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.02 -45.29 94.26 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 121.81 0.814 . . . . 27.510000000000002 111.624 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -49.88 -57.46 9.78 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 116.032 1.173 . . . . 25.57 116.032 172.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.6 -41.82 70.38 Favored 'General case' 0 C--O 1.265 1.878 0 C-N-CA 123.893 0.877 . . . . 26.600000000000001 111.193 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 tp -59.3 -40.47 86.31 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.059 -0.973 . . . . 28.960000000000001 112.754 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' MET . . . . . . . . . . . . . 10.3 mmt -94.14 -10.63 32.58 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.334 0.654 . . . . 37.049999999999997 112.556 -173.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -143.06 75.83 1.5 Allowed 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.519 -0.919 . . . . 40.920000000000002 108.519 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.45 -16.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 115.389 1.626 . . . . 35.770000000000003 115.389 -165.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . 0.276 61.1 m-20 -94.7 0.03 54.7 Favored 'General case' 0 C--O 1.275 2.43 0 N-CA-C 115.963 1.838 . . . . 34.460000000000001 115.963 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.36 109.88 18.37 Favored Pre-proline 0 N--CA 1.474 0.753 0 N-CA-C 112.997 0.74 . . . . 36.0 112.997 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -72.59 -20.44 23.37 Favored 'Trans proline' 0 CA--C 1.505 -0.949 0 N-CA-C 115.195 1.19 . . . . 31.399999999999999 115.195 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -68.44 -26.15 65.38 Favored 'General case' 0 C--O 1.177 -2.756 0 CA-C-O 117.671 -1.157 . . . . 42.740000000000002 113.672 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -64.02 -61.18 7.24 Favored Pre-proline 0 C--O 1.2 -1.549 0 N-CA-C 116.526 2.047 . . . . 26.780000000000001 116.526 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -58.63 -32.13 96.11 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 115.86 -2.293 . . . . 26.140000000000001 115.372 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -59.86 -52.86 63.64 Favored 'General case' 0 C--O 1.241 0.629 0 O-C-N 121.063 -1.023 . . . . 42.479999999999997 111.267 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -71.21 -30.49 66.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-O 118.546 -0.74 . . . . 34.039999999999999 111.587 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.3 86.88 Favored 'General case' 0 C--O 1.208 -1.081 0 N-CA-C 108.896 -0.779 . . . . 31.43 108.896 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.35 -47.6 81.48 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.868 -0.79 . . . . 36.579999999999998 108.868 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -47.13 -47.74 23.37 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.071 -0.966 . . . . 46.170000000000002 112.009 173.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.84 -36.16 81.7 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 115.406 1.632 . . . . 38.200000000000003 115.406 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -59.72 -38.97 83.15 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.776 -1.194 . . . . 36.159999999999997 107.776 176.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.0 mt -62.54 -57.88 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.455 0.702 . . . . 45.100000000000001 112.009 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -52.82 -30.34 32.88 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.295 -0.866 . . . . 47.0 112.061 171.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.48 4.35 28.21 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.515 -0.741 . . . . 47.18 111.266 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 52.0 43.3 55.5 Favored Glycine 0 N--CA 1.472 1.093 0 N-CA-C 116.859 1.504 . . . . 46.340000000000003 116.859 -169.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -116.46 87.56 2.71 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 105.712 -1.958 . . . . 49.75 105.712 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 2.9 mt -76.64 -27.44 55.66 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 118.338 -1.345 . . . . 48.049999999999997 111.573 -172.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -56.57 -48.16 77.97 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 119.785 1.175 . . . . 47.799999999999997 108.152 169.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.59 -45.37 96.45 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.237 0.336 . . . . 38.990000000000002 112.413 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.98 95.24 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-O 121.161 0.505 . . . . 35.909999999999997 110.296 -176.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -64.7 -48.83 73.25 Favored 'General case' 0 CA--C 1.504 -0.799 0 N-CA-C 107.614 -1.254 . . . . 52.799999999999997 107.614 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.3 m -54.04 -48.07 70.91 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.407 2.003 . . . . 36.159999999999997 116.407 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -67.42 -44.62 83.6 Favored Glycine 0 C--O 1.217 -0.966 0 N-CA-C 106.491 -2.644 . . . . 30.920000000000002 106.491 -175.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -66.25 -40.11 89.96 Favored 'General case' 0 N--CA 1.503 2.2 0 C-N-CA 118.64 -1.224 . . . . 38.079999999999998 110.967 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -60.34 -50.16 74.74 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 114.566 -1.197 . . . . 44.210000000000001 109.101 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 7.6 m -62.88 -41.39 99.39 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 119.312 -0.955 . . . . 33.950000000000003 111.272 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.37 89.9 Favored 'General case' 0 CA--C 1.478 -1.795 0 N-CA-C 107.684 -1.228 . . . . 33.079999999999998 107.684 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ARG . . . . . 0.429 ' NH1' HD23 ' B' ' 151' ' ' LEU . 59.7 ttp180 -58.33 -46.81 85.5 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 125.133 1.521 . . . . 47.899999999999999 111.818 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.69 91.97 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 114.966 1.469 . . . . 33.530000000000001 114.966 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.69 -47.39 72.56 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 116.017 -0.538 . . . . 34.0 111.524 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.73 98.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.827 0.851 . . . . 35.509999999999998 112.236 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.61 -29.0 67.68 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 112.532 0.568 . . . . 35.600000000000001 112.532 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -83.79 1.51 42.62 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 118.404 -1.318 . . . . 38.390000000000001 114.263 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' B' ' 138' ' ' PRO . 46.7 mt-30 -127.12 117.09 21.86 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 113.758 1.021 . . . . 53.270000000000003 113.758 -174.368 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 137' ' ' GLN . 45.9 Cg_exo -61.03 -39.47 59.95 Favored 'Trans proline' 0 N--CA 1.478 0.595 0 N-CA-C 113.428 0.511 . . . . 46.460000000000001 113.428 -172.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.22 -32.89 68.73 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 113.865 1.061 . . . . 50.920000000000002 113.865 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -98.7 28.71 4.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.875 -0.602 . . . . 53.979999999999997 112.247 -177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.13 -42.26 89.38 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 119.342 -0.943 . . . . 58.310000000000002 113.122 -171.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -55.16 -51.88 65.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.27 -0.877 . . . . 49.57 111.372 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 59.7 tp -51.89 -40.38 60.57 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.953 1.094 . . . . 48.5 113.953 -175.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.53 -33.58 6.57 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 113.769 1.025 . . . . 51.030000000000001 113.769 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.65 -16.45 23.14 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 116.735 2.124 . . . . 52.890000000000001 116.735 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' ARG . . . . . 0.655 ' HD3' ' O ' ' B' 2033 ' ' HOH . 0.3 OUTLIER -62.27 -41.69 98.68 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 117.267 -1.773 . . . . 59.350000000000001 108.319 163.051 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.67 -53.5 46.42 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.565 0.746 . . . . 51.659999999999997 110.369 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . -47.09 -50.75 15.38 Favored Glycine 0 N--CA 1.475 1.286 0 O-C-N 124.644 1.215 . . . . 55.200000000000003 113.078 174.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.67 -42.89 81.4 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 117.92 0.86 . . . . 56.93 110.76 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 69.5 mmm -64.52 -36.54 84.53 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.245 -0.889 . . . . 62.729999999999997 111.936 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' LEU . . . . . 0.429 HD23 ' NH1' ' B' ' 131' ' ' ARG . 54.0 tp -56.83 -53.56 56.51 Favored 'General case' 0 CA--C 1.559 1.318 0 N-CA-C 112.872 0.693 . . . . 58.869999999999997 112.872 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLU . . . . . 0.7 ' HG2' ' O ' ' B' 2034 ' ' HOH . 70.1 mt-10 -53.92 -40.76 66.98 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.686 0.995 . . . . 70.150000000000006 113.686 175.116 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -51.04 -53.9 29.48 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.479 -0.328 . . . . 64.299999999999997 111.845 170.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . . . -63.12 -50.31 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 114.139 1.163 . . . . 63.82 114.139 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 12.2 p -55.0 -13.53 1.16 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.322 1.23 . . . . 64.290000000000006 114.322 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.46 0 C-N-CA 122.811 0.444 . . . . 63.560000000000002 110.51 167.888 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.145 0 N-CA-C 109.168 -0.679 . . . . 37.399999999999999 109.168 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.44 137.39 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 119.22 0.918 . . . . 33.539999999999999 110.574 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' GLU . . . . . 0.914 ' HG3' ' O ' ' C' 2002 ' ' HOH . 1.1 pm0 -93.47 111.94 23.73 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.307 -1.368 . . . . 38.280000000000001 107.307 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 34.5 mt -81.89 150.12 27.93 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.868 1.062 . . . . 31.350000000000001 113.868 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.04 133.78 52.09 Favored 'General case' 0 N--CA 1.503 2.195 0 CA-C-O 117.831 -1.081 . . . . 37.450000000000003 110.638 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.63 143.64 98.23 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 106.584 -1.635 . . . . 33.939999999999998 106.584 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' C' ' 55' ' ' ARG . 3.5 Cg_exo -72.53 -115.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.258 0 N-CA-C 115.193 1.19 . . . . 42.369999999999997 115.193 178.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ARG . . . . . 0.782 ' CG ' ' O ' ' C' 2001 ' ' HOH . 1.6 tpm_? . . . . . 0 N--CA 1.507 2.423 0 C-N-CA 125.594 1.558 . . . . 55.640000000000001 114.76 -171.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1157 ' ' NO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . 0.408 ' O ' ' HG3' ' A' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2045 ' ' HOH . . . . . 0.51 ' O ' ' CD ' ' A' ' 141' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2047 ' ' HOH . . . . . 0.711 ' O ' ' CD ' ' A' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2001 ' ' HOH . . . . . 0.625 ' O ' ' HG3' ' B' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2002 ' ' HOH . . . . . 1.158 ' O ' ' HA ' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2003 ' ' HOH . . . . . 1.127 ' O ' ' HG3' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2007 ' ' HOH . . . . . 0.508 ' O ' ' HB3' ' B' ' 45' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2015 ' ' HOH . . . . . 1.017 ' O ' ' CE2' ' B' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2018 ' ' HOH . . . . . 0.589 ' O ' ' HG3' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2019 ' ' HOH . . . . . 0.456 ' O ' ' CD ' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2031 ' ' HOH . . . . . 0.587 ' O ' ' HB2' ' B' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2033 ' ' HOH . . . . . 0.655 ' O ' ' HD3' ' B' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2034 ' ' HOH . . . . . 0.7 ' O ' ' HG2' ' B' ' 152' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2001 ' ' HOH . . . . . 0.782 ' O ' ' CG ' ' C' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 2002 ' ' HOH . . . . . 0.914 ' O ' ' HG3' ' C' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.506 2.363 0 N-CA-C 112.933 0.716 . . . . 55.560000000000002 112.933 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 mt -93.75 -4.88 49.58 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.097 1.359 . . . . 53.200000000000003 113.25 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.703 ' HE ' ' CE1' ' B' ' 67' ' ' HIS . 0.4 OUTLIER -52.9 136.79 33.81 Favored 'General case' 0 C--O 1.215 -0.733 0 O-C-N 121.067 -1.021 . . . . 73.849999999999994 112.509 -179.692 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 96.04 9.93 56.68 Favored Glycine 0 C--O 1.258 1.619 0 N-CA-C 115.853 1.101 . . . . 47.359999999999999 115.853 173.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 78.2 mt -63.87 148.14 50.14 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 114.391 1.256 . . . . 39.439999999999998 114.391 176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 87.1 p -69.85 164.36 23.87 Favored 'General case' 0 C--O 1.227 -0.112 0 C-N-CA 119.055 -1.058 . . . . 35.439999999999998 109.044 -179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 62.1 tt0 -63.36 -36.09 82.57 Favored 'General case' 0 CA--C 1.508 -0.648 0 O-C-N 124.224 0.952 . . . . 43.090000000000003 109.521 177.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -65.98 -36.06 82.27 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.057 -1.057 . . . . 46.060000000000002 112.577 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 95.7 m -69.61 -45.42 68.6 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 123.767 0.667 . . . . 31.550000000000001 111.906 172.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 71.4 mt -50.09 -43.77 51.59 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 115.186 1.55 . . . . 33.960000000000001 115.186 168.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -60.17 -42.68 95.5 Favored 'General case' 0 N--CA 1.445 -0.683 0 O-C-N 121.688 -0.632 . . . . 39.700000000000003 112.389 177.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -69.11 -32.13 71.31 Favored 'General case' 0 C--O 1.261 1.683 0 C-N-CA 119.341 -0.944 . . . . 45.810000000000002 113.202 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 1.1 tp -71.6 -37.56 70.94 Favored 'General case' 0 C--N 1.319 -0.729 0 C-N-CA 119.666 -0.814 . . . . 29.940000000000001 111.542 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 76.6 t80 -60.37 -45.89 91.92 Favored 'General case' 0 C--O 1.243 0.756 0 C-N-CA 119.775 -0.77 . . . . 26.59 111.939 171.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -52.21 -41.31 62.6 Favored 'General case' 0 C--O 1.266 1.961 0 N-CA-C 114.264 1.209 . . . . 27.77 114.264 172.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.1 tt -65.5 -46.54 79.31 Favored 'General case' 0 C--O 1.246 0.884 0 N-CA-C 107.57 -1.27 . . . . 39.25 107.57 -176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -63.83 -45.5 94.08 Favored Glycine 0 C--O 1.203 -1.841 0 O-C-N 124.062 0.851 . . . . 29.07 112.372 179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -56.13 -41.67 75.7 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-N 117.371 0.586 . . . . 34.340000000000003 110.964 175.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -69.62 -41.18 76.01 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 119.919 -0.713 . . . . 39.369999999999997 111.937 -175.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.41 ' NE2' ' HD2' ' A' ' 51' ' ' LYS . 9.9 mm100 -60.32 -40.8 91.89 Favored 'General case' 0 C--O 1.263 1.765 0 O-C-N 123.811 0.694 . . . . 42.490000000000002 111.635 173.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 81.0 t80 -57.21 -51.43 69.35 Favored 'General case' 0 C--N 1.344 0.368 0 N-CA-C 113.08 0.77 . . . . 31.16 113.08 171.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 64.4 mm-40 -56.74 -28.81 61.78 Favored 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 112.508 0.558 . . . . 45.729999999999997 112.508 177.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -92.5 6.74 46.02 Favored 'General case' 0 CA--C 1.555 1.152 0 O-C-N 121.132 -0.98 . . . . 35.210000000000001 111.112 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.77 13.47 80.53 Favored Glycine 0 C--O 1.256 1.48 0 C-N-CA 119.522 -1.323 . . . . 32.189999999999998 113.052 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.649 ' HZ3' ' H ' ' A' ' 54' ' ' ASP . 26.8 mttp -88.29 76.49 8.37 Favored 'General case' 0 C--O 1.269 2.084 0 N-CA-C 108.306 -0.998 . . . . 36.359999999999999 108.306 175.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TRP . . . . . . . . . . . . . 8.3 m0 -70.3 -33.88 72.06 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 116.442 2.015 . . . . 43.670000000000002 116.442 -168.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.448 ' HB2' ' HZ1' ' A' ' 51' ' ' LYS . 0.6 OUTLIER -67.14 -39.15 86.52 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.078 0.77 . . . . 46.43 113.078 179.373 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.649 ' H ' ' HZ3' ' A' ' 51' ' ' LYS . 34.5 m-20 -73.06 -42.82 62.67 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 114.553 -1.203 . . . . 28.100000000000001 109.84 179.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -62.36 -42.9 99.77 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 108.706 -0.85 . . . . 24.859999999999999 108.706 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -55.36 -44.33 75.88 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 118.167 -1.413 . . . . 26.52 112.525 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -65.17 -43.31 92.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.763 -0.653 . . . . 39.659999999999997 111.643 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 17.4 mm -60.35 -43.02 92.87 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.374 0 C-N-CA 118.724 -1.191 . . . . 30.969999999999999 112.387 175.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -70.03 -36.99 75.47 Favored 'General case' 0 C--N 1.355 0.819 0 C-N-CA 118.106 -1.438 . . . . 24.210000000000001 112.24 -179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 34.7 tp60 -60.32 -38.94 85.27 Favored 'General case' 0 N--CA 1.412 -2.366 0 N-CA-C 107.272 -1.381 . . . . 47.719999999999999 107.272 176.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -63.65 -51.38 65.39 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 118.52 -1.272 . . . . 23.23 108.67 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 19.7 mt -58.88 -44.38 91.1 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 115.331 1.604 . . . . 25.109999999999999 115.331 -178.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 83.9 m -53.1 -31.51 42.39 Favored 'General case' 0 C--O 1.264 1.832 0 N-CA-C 114.048 1.129 . . . . 23.309999999999999 114.048 168.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 72.0 mtm -73.64 -41.21 63.06 Favored 'General case' 0 N--CA 1.505 2.309 0 N-CA-C 113.988 1.107 . . . . 45.560000000000002 113.988 170.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 68.1 mt -72.36 -31.15 65.35 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 114.216 1.191 . . . . 30.670000000000002 114.216 -179.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -141.57 99.89 3.65 Favored 'General case' 0 CA--C 1.49 -1.362 0 N-CA-C 110.002 -0.37 . . . . 26.469999999999999 110.002 -179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.564 ' HD2' ' O3 ' ' B' 1157 ' ' NO3 . 3.6 m-70 -71.65 -0.12 10.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.63 1.715 . . . . 30.600000000000001 115.63 -172.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 54.3 m-85 -127.57 -7.02 5.72 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 114.218 1.192 . . . . 38.100000000000001 114.218 -167.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -84.42 101.4 11.98 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 107.757 -1.201 . . . . 27.960000000000001 107.757 -175.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -51.92 -33.94 39.46 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 113.926 1.084 . . . . 22.07 113.926 -177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 56.5 mtm180 -52.14 -38.6 58.09 Favored 'General case' 0 C--O 1.278 2.599 0 O-C-N 120.964 -1.085 . . . . 32.030000000000001 113.323 177.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 13.8 m-30 -68.19 -31.75 71.5 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 119.468 -0.893 . . . . 25.039999999999999 110.298 -175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -81.59 -33.26 31.67 Favored 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 119.988 -0.685 . . . . 19.550000000000001 111.0 -175.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 28.3 tp -59.08 -51.44 70.03 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 125.166 1.386 . . . . 20.190000000000001 107.597 168.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.7 -48.96 78.05 Favored Glycine 0 N--CA 1.497 2.711 0 C-N-CA 120.873 -0.68 . . . . 18.260000000000002 113.987 177.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 35.6 tp -61.25 -52.76 63.4 Favored 'General case' 0 C--O 1.269 2.091 0 N-CA-C 106.576 -1.638 . . . . 18.629999999999999 106.576 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -50.1 -47.98 40.14 Favored Glycine 1 N--CA 1.529 4.874 0 C-N-CA 119.847 -1.168 . . . . 18.550000000000001 114.831 176.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -63.09 -38.78 92.54 Favored 'General case' 0 N--CA 1.427 -1.575 0 CA-C-N 117.926 0.863 . . . . 19.75 110.099 -176.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -63.92 -45.32 89.79 Favored 'General case' 0 CA--C 1.495 -1.157 0 N-CA-C 113.222 0.823 . . . . 23.789999999999999 113.222 178.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 87.4 mtt180 -66.35 -41.35 89.65 Favored 'General case' 0 CA--C 1.563 1.449 0 O-C-N 124.336 1.023 . . . . 22.899999999999999 112.066 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -53.21 -49.15 67.37 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.247 -0.888 . . . . 23.789999999999999 111.717 172.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 m -66.22 -23.48 66.44 Favored 'General case' 0 C--N 1.342 0.258 0 N-CA-C 113.056 0.761 . . . . 31.379999999999999 113.056 -176.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 78.0 mt -93.04 2.01 56.98 Favored 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 124.582 1.153 . . . . 28.539999999999999 113.185 175.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 78.7 15.69 80.37 Favored Glycine 0 CA--C 1.472 -2.613 0 C-N-CA 118.787 -1.673 . . . . 24.050000000000001 114.174 178.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 96.0 mt -94.1 69.96 3.85 Favored 'General case' 0 N--CA 1.443 -0.818 0 C-N-CA 118.904 -1.118 . . . . 27.82 108.885 177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' TYR . . . . . 0.726 ' CZ ' ' HG2' ' A' ' 116' ' ' GLN . 54.4 m-85 -65.59 -39.83 92.03 Favored 'General case' 0 C--O 1.203 -1.387 0 N-CA-C 116.286 1.958 . . . . 27.16 116.286 -169.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.408 ' HG3' ' O ' ' A' 2020 ' ' HOH . 19.2 mm-40 -61.48 -45.06 95.84 Favored 'General case' 0 C--O 1.252 1.226 0 C-N-CA 120.475 -0.49 . . . . 30.52 110.193 179.652 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -69.5 -32.48 71.38 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.395 -0.922 . . . . 40.920000000000002 111.574 177.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.69 -41.1 98.17 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 108.548 -0.908 . . . . 19.370000000000001 108.548 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 56.3 mt -62.6 -43.75 98.04 Favored 'General case' 0 CA--C 1.572 1.823 0 C-N-CA 117.715 -1.594 . . . . 20.449999999999999 110.519 -179.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 -54.82 -41.78 71.07 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 118.491 0.587 . . . . 33.689999999999998 111.781 178.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 8.3 t -71.1 -43.92 66.7 Favored 'General case' 0 C--O 1.279 2.638 0 CA-C-O 123.339 1.543 . . . . 24.09 114.183 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -61.26 -40.59 94.65 Favored 'General case' 0 C--O 1.209 -1.065 0 CA-C-N 114.02 -1.445 . . . . 20.350000000000001 110.583 173.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.1 t -62.52 -44.72 95.66 Favored 'General case' 0 C--O 1.256 1.4 0 O-C-N 120.965 -1.085 . . . . 18.789999999999999 111.908 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 72.6 t80 -67.09 -45.59 76.82 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.433 -1.307 . . . . 22.460000000000001 111.596 177.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -51.04 -49.46 42.78 Favored Glycine 0 N--CA 1.432 -1.572 0 C-N-CA 118.807 -1.663 . . . . 20.350000000000001 113.494 177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.95 -34.28 63.1 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.661 -0.905 . . . . 20.949999999999999 111.321 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.47 -32.41 73.85 Favored 'General case' 0 CA--C 1.571 1.761 0 N-CA-C 113.371 0.878 . . . . 26.440000000000001 113.371 171.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' MET . . . . . . . . . . . . . 36.4 mmt -81.47 -27.77 34.44 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 113.223 0.823 . . . . 25.82 113.223 -179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -140.46 92.46 2.52 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 107.422 -1.325 . . . . 28.370000000000001 107.422 174.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 22.1 pt -66.07 -13.64 16.14 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.685 0 N-CA-C 113.838 1.051 . . . . 26.82 113.838 -173.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -91.61 -13.32 32.11 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 115.872 1.805 . . . . 29.280000000000001 115.872 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -79.36 114.09 42.15 Favored Pre-proline 0 C--O 1.259 1.584 0 CA-C-O 121.316 0.579 . . . . 29.050000000000001 111.804 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.25 -22.75 29.39 Favored 'Trans proline' 0 C--O 1.246 0.895 0 C-N-CA 123.757 2.972 . . . . 23.07 112.769 -178.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ARG . . . . . . . . . . . . . 83.5 mtm180 -61.61 -36.74 81.59 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 113.706 1.002 . . . . 29.670000000000002 113.706 -178.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -59.11 -59.61 13.27 Favored Pre-proline 0 C--O 1.211 -0.96 0 C-N-CA 120.015 -0.674 . . . . 25.609999999999999 111.361 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -71.73 -26.81 18.93 Favored 'Trans proline' 0 C--O 1.18 -2.389 0 C-N-CA 114.441 -3.239 . . . . 16.350000000000001 110.923 -174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 81.6 t80 -63.3 -55.49 24.3 Favored 'General case' 0 C--O 1.273 2.298 0 C-N-CA 119.597 -0.841 . . . . 22.57 111.056 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -70.35 -28.46 65.15 Favored 'General case' 0 N--CA 1.441 -0.912 0 C-N-CA 118.081 -1.447 . . . . 22.23 111.814 -178.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.4 -41.4 97.07 Favored 'General case' 0 CA--C 1.558 1.252 0 O-C-N 124.603 1.189 . . . . 17.52 109.492 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ALA . . . . . . . . . . . . . . . -62.17 -41.6 98.48 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 114.956 -1.02 . . . . 19.75 109.596 179.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 87.3 mt-10 -56.2 -41.34 75.43 Favored 'General case' 0 C--O 1.291 3.238 0 N-CA-C 115.609 1.707 . . . . 29.77 115.609 173.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' CYS . . . . . . . . . . . . . 75.7 m -67.07 -43.18 83.28 Favored 'General case' 0 C--O 1.21 -0.994 0 CA-C-O 117.436 -1.268 . . . . 20.98 107.59 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HIS . . . . . . . . . . . . . 52.7 m-70 -59.48 -39.29 83.25 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 118.93 -1.108 . . . . 22.510000000000002 110.592 -179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.69 -47.86 81.81 Favored 'General case' 0 C--O 1.25 1.088 0 CA-C-N 115.415 -0.812 . . . . 28.52 109.785 -179.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLN . . . . . 0.726 ' HG2' ' CZ ' ' A' ' 86' ' ' TYR . 77.4 mm-40 -61.05 -26.07 67.37 Favored 'General case' 0 C--O 1.253 1.267 0 C-N-CA 119.524 -0.87 . . . . 23.41 111.698 178.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.714 HD11 ' HB2' ' A' ' 86' ' ' TYR . 1.0 OUTLIER -88.16 -1.32 57.94 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 119.655 -0.818 . . . . 28.91 112.397 174.646 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . 81.73 20.75 63.01 Favored Glycine 0 C--O 1.261 1.794 0 C-N-CA 119.192 -1.48 . . . . 27.420000000000002 111.896 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 57.2 t0 -108.18 94.09 4.88 Favored 'General case' 0 C--O 1.204 -1.308 0 N-CA-C 107.049 -1.463 . . . . 32.5 107.049 -175.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 43.1 mt -71.67 -36.28 70.58 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 116.565 2.061 . . . . 35.869999999999997 116.565 -173.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -64.86 -44.61 89.16 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-N 115.144 -0.935 . . . . 34.840000000000003 111.585 176.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . -59.61 -40.97 97.08 Favored Glycine 0 CA--C 1.533 1.175 0 C-N-CA 118.69 -1.719 . . . . 21.52 110.513 173.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -70.42 -42.29 71.8 Favored 'General case' 0 C--O 1.245 0.844 0 O-C-N 120.077 -1.837 . . . . 19.579999999999998 109.197 -174.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -56.71 -48.79 76.95 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.538 -0.756 . . . . 32.229999999999997 110.769 178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 18.2 m -55.78 -47.74 76.54 Favored 'General case' 0 C--O 1.253 1.282 0 O-C-N 123.672 0.608 . . . . 24.239999999999998 110.291 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . -64.19 -46.0 92.15 Favored Glycine 0 N--CA 1.497 2.758 0 C-N-CA 120.457 -0.878 . . . . 21.82 111.786 -174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -68.79 -38.15 79.78 Favored 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 108.185 -1.042 . . . . 24.0 108.185 -176.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -55.73 -54.45 44.22 Favored 'General case' 0 C--O 1.281 2.757 0 N-CA-C 113.567 0.951 . . . . 24.84 113.567 171.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 74.8 m -55.64 -48.27 75.25 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 116.068 -0.515 . . . . 19.489999999999998 111.225 175.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.89 -39.51 89.55 Favored 'General case' 0 C--O 1.254 1.307 0 O-C-N 123.636 0.585 . . . . 21.359999999999999 110.685 -178.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ARG . . . . . . . . . . . . . 54.7 ttp180 -65.86 -43.12 89.35 Favored 'General case' 0 C--O 1.201 -1.465 0 C-N-CA 116.267 -2.173 . . . . 42.270000000000003 109.782 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ALA . . . . . . . . . . . . . . . -60.46 -45.81 92.35 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 120.701 -0.399 . . . . 24.370000000000001 111.17 179.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 80.6 mt -67.78 -43.46 79.7 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 119.634 -0.826 . . . . 26.739999999999998 109.534 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -69.34 -36.23 76.68 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 119.369 -0.932 . . . . 24.699999999999999 109.616 -176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.3 -29.22 67.45 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 113.703 1.001 . . . . 25.989999999999998 113.703 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -80.41 -1.92 43.44 Favored 'General case' 0 CA--C 1.563 1.452 0 N-CA-C 114.341 1.237 . . . . 31.420000000000002 114.341 -177.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLN . . . . . . . . . . . . . 46.1 mt-30 -135.54 118.23 12.49 Favored Pre-proline 0 N--CA 1.479 0.99 0 CA-C-N 118.743 0.701 . . . . 49.140000000000001 111.616 -171.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_exo -59.33 -32.57 96.93 Favored 'Trans proline' 0 CA--C 1.554 1.49 0 N-CA-C 115.921 1.469 . . . . 43.619999999999997 115.921 -177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ALA . . . . . . . . . . . . . . . -53.88 -25.4 19.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 114.005 1.113 . . . . 45.390000000000001 114.005 172.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 -110.51 28.24 8.86 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.739 1.385 . . . . 48.619999999999997 114.739 -174.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . 0.51 ' CD ' ' O ' ' A' 2045 ' ' HOH . 38.0 tt0 -60.34 -39.56 87.56 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.283 1.957 . . . . 54.899999999999999 116.283 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . -66.26 -40.81 90.43 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 121.186 -0.946 . . . . 38.950000000000003 111.976 176.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' LEU . . . . . . . . . . . . . 22.0 tp -66.12 -41.12 90.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 CA-C-O 118.435 -0.793 . . . . 32.549999999999997 110.946 -178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -54.44 -47.59 72.68 Favored 'General case' 0 C--O 1.216 -0.667 0 O-C-N 124.307 1.005 . . . . 30.23 110.14 176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . -64.43 -38.46 91.1 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.197 0.443 . . . . 30.920000000000002 112.197 177.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ARG . . . . . 0.711 ' CD ' ' O ' ' A' 2047 ' ' HOH . 74.4 mtp180 -67.61 -40.99 84.68 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-O 118.539 -0.743 . . . . 36.869999999999997 111.408 176.589 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' ALA . . . . . . . . . . . . . . . -63.45 -39.4 94.36 Favored 'General case' 0 N--CA 1.434 -1.257 0 N-CA-C 108.525 -0.917 . . . . 25.809999999999999 108.525 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -67.84 -43.36 83.8 Favored Glycine 0 N--CA 1.481 1.657 0 N-CA-C 108.739 -1.744 . . . . 27.0 108.739 179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ALA . . . . . . . . . . . . . . . -61.26 -48.21 82.47 Favored 'General case' 0 C--O 1.266 1.956 0 CA-C-N 117.538 0.669 . . . . 27.23 112.6 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' MET . . . . . . . . . . . . . 94.7 mmm -62.27 -42.58 99.47 Favored 'General case' 0 C--O 1.257 1.488 0 N-CA-C 113.156 0.799 . . . . 30.370000000000001 113.156 176.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LEU . . . . . . . . . . . . . 65.6 tp -56.87 -46.64 81.7 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 118.764 -1.174 . . . . 28.800000000000001 111.894 176.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 57.2 mt-10 -59.05 -42.51 90.44 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.641 -0.709 . . . . 53.950000000000003 109.499 179.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ALA . . . . . . . . . . . . . . . -61.71 -45.28 94.64 Favored 'General case' 0 CA--C 1.489 -1.401 0 CA-C-N 115.654 -0.703 . . . . 28.210000000000001 110.401 -179.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 41.7 t -67.54 -42.32 86.76 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 113.776 1.028 . . . . 27.539999999999999 113.776 -178.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' THR . . . . . . . . . . . . . 96.2 m -60.65 -42.91 97.92 Favored 'General case' 0 C--O 1.262 1.754 0 O-C-N 121.776 -0.578 . . . . 33.0 109.576 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' ALA . . . . . . . . . . . . . . . -53.84 -41.23 67.2 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 123.859 0.724 . . . . 29.57 112.735 174.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ARG . . . . . . . . . . . . . 2.4 mtm-85 -70.16 -37.92 75.33 Favored 'General case' 0 C--O 1.248 0.993 0 N-CA-C 111.389 0.144 . . . . 33.490000000000002 111.389 179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LYS . . . . . . . . . . . . . 31.8 mtpt -71.32 -31.87 67.93 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 118.433 -1.307 . . . . 36.539999999999999 109.71 178.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 . . . . . 0 N--CA 1.466 0.343 0 N-CA-C 108.948 -0.76 . . . . 46.310000000000002 108.948 -178.807 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.182 0 N-CA-C 112.346 0.498 . . . . 63.590000000000003 112.346 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . 0.633 ' O ' ' HG3' ' B' ' 29' ' ' ARG . . . -52.19 -53.02 48.52 Favored 'General case' 0 C--O 1.244 0.802 0 C-N-CA 123.232 0.613 . . . . 62.920000000000002 111.725 172.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' MET . . . . . 0.446 ' C ' ' SD ' ' B' ' 27' ' ' MET . 0.0 OUTLIER -74.81 -42.13 58.65 Favored 'General case' 0 C--O 1.254 1.302 0 C-N-CA 119.144 -1.022 . . . . 67.519999999999996 112.276 -175.357 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LEU . . . . . . . . . . . . . 1.8 tp -70.65 3.83 2.87 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 124.104 0.962 . . . . 52.920000000000002 113.094 -174.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' B' ' 26' ' ' ALA . 0.5 OUTLIER -60.23 136.8 58.14 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 114.731 1.382 . . . . 63.270000000000003 114.731 175.427 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.37 25.88 38.12 Favored Glycine 0 N--CA 1.47 0.915 0 N-CA-C 118.077 1.991 . . . . 45.990000000000002 118.077 169.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.489 HD22 HG21 ' B' ' 35' ' ' THR . 71.1 mt -67.86 153.08 44.49 Favored 'General case' 0 C--N 1.314 -0.959 0 O-C-N 121.427 -1.043 . . . . 40.920000000000002 111.61 178.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -68.04 167.93 12.95 Favored 'General case' 0 N--CA 1.444 -0.742 0 N-CA-C 109.13 -0.693 . . . . 41.82 109.13 178.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLU . . . . . 1.158 ' HA ' ' O ' ' B' 2002 ' ' HOH . 2.1 mt-10 -55.09 -48.03 74.12 Favored 'General case' 0 C--O 1.265 1.891 0 O-C-N 124.962 1.414 . . . . 46.439999999999998 112.07 175.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ASP . . . . . 0.738 ' OD2' ' OE2' ' B' ' 33' ' ' GLU . 15.8 t70 -67.6 -37.17 82.17 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 115.121 -0.945 . . . . 41.469999999999999 111.546 -174.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' THR . . . . . 0.489 HG21 HD22 ' B' ' 31' ' ' LEU . 24.3 m -67.87 -50.78 54.51 Favored 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 109.06 -0.719 . . . . 35.450000000000003 109.06 -178.397 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.879 HD12 ' O ' ' B' 2002 ' ' HOH . 63.9 mt -49.54 -46.23 48.42 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 123.948 0.78 . . . . 33.189999999999998 111.093 173.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 46.6 tp10 -64.37 -41.77 96.53 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 118.858 -1.137 . . . . 39.57 112.856 -179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . 0.632 ' HG3' ' O ' ' B' ' 34' ' ' ASP . 64.8 mt-30 -65.21 -34.23 77.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.704 0.764 . . . . 43.880000000000003 109.232 177.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' LEU . . . . . . . . . . . . . 27.0 tp -69.06 -46.87 66.76 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.394 -0.965 . . . . 30.510000000000002 108.394 179.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' TYR . . . . . . . . . . . . . 40.7 t80 -51.9 -49.63 62.64 Favored 'General case' 0 C--O 1.214 -0.769 0 CA-C-N 115.171 -0.922 . . . . 47.68 108.97 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -63.52 -32.18 73.56 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 114.412 1.264 . . . . 31.449999999999999 114.412 -178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tt -64.02 -46.21 85.46 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 113.136 0.791 . . . . 39.560000000000002 113.136 170.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -51.98 -49.12 50.13 Favored Glycine 0 N--CA 1.472 1.048 0 CA-C-O 122.091 0.828 . . . . 31.899999999999999 113.246 172.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -60.8 -49.04 79.09 Favored 'General case' 0 N--CA 1.441 -0.912 0 N-CA-C 108.314 -0.995 . . . . 47.310000000000002 108.314 -179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASN . . . . . 0.508 ' HB3' ' O ' ' B' 2007 ' ' HOH . 34.2 m-20 -56.69 -42.31 78.88 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.207 -0.906 . . . . 49.890000000000001 111.984 -176.622 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLN . . . . . . . . . . . . . 9.5 mm100 -71.39 -31.7 67.58 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.03 0.381 . . . . 40.640000000000001 112.03 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 63.6 t80 -65.56 -55.67 16.48 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 108.023 -1.103 . . . . 42.630000000000003 108.023 174.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' GLN . . . . . . . . . . . . . 63.3 mm-40 -51.52 -24.66 5.48 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 114.99 1.478 . . . . 47.490000000000002 114.99 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' ALA . . . . . . . . . . . . . . . -87.65 -2.78 58.84 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 115.938 1.829 . . . . 44.810000000000002 115.938 176.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 89.19 -2.09 83.27 Favored Glycine 0 C--O 1.262 1.897 0 C-N-CA 119.232 -1.461 . . . . 44.229999999999997 114.653 177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.406 ' HD2' ' HA ' ' B' ' 51' ' ' LYS . 0.6 OUTLIER -86.2 77.7 9.51 Favored 'General case' 0 C--O 1.258 1.516 0 CA-C-O 122.722 1.249 . . . . 48.329999999999998 109.887 173.871 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' TRP . . . . . . . . . . . . . 17.8 m0 -77.05 -36.78 55.75 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 114.352 -1.295 . . . . 42.0 114.191 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . 0.283 34.0 t0 -60.85 -48.34 82.25 Favored 'General case' 0 CA--C 1.503 -0.83 0 C-N-CA 114.657 -2.817 . . . . 32.560000000000002 111.977 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -60.83 -51.56 68.79 Favored 'General case' 0 N--CA 1.479 0.987 0 CA-C-N 119.194 0.906 . . . . 39.93 109.68 170.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.05 -45.36 68.03 Favored 'General case' 0 CA--C 1.562 1.432 0 N-CA-C 113.856 1.058 . . . . 27.620000000000001 113.856 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -51.62 -48.51 63.26 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-O 121.539 0.685 . . . . 37.479999999999997 111.251 178.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -66.71 -39.58 88.1 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 108.981 -0.748 . . . . 39.380000000000003 108.981 -177.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 39.8 mm -63.94 -48.22 87.1 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.388 0 C-N-CA 118.498 -1.281 . . . . 30.460000000000001 110.956 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -61.9 -42.16 98.76 Favored 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 118.805 -0.617 . . . . 27.600000000000001 111.985 -179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . 0.647 HE21 HH21 ' B' ' 80' ' ' ARG . 28.0 tp60 -53.57 -52.75 58.74 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.209 -0.997 . . . . 27.41 110.196 178.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -54.93 -52.79 61.88 Favored 'General case' 0 C--O 1.215 -0.729 0 C-N-CA 120.315 -0.554 . . . . 27.699999999999999 111.094 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.1 mt -52.87 -42.15 64.99 Favored 'General case' 0 C--O 1.25 1.093 0 N-CA-C 114.324 1.231 . . . . 28.710000000000001 114.324 176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' CYS . . . . . . . . . . . . . 81.4 m -61.34 -32.1 71.98 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 112.591 0.589 . . . . 32.280000000000001 112.591 178.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.4 -39.83 16.0 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.622 1.169 . . . . 53.130000000000003 110.965 -176.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 53.3 mt -87.14 -38.38 16.48 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.15 0.5 . . . . 42.700000000000003 112.135 -169.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ASP . . . . . 0.486 ' HB3' ' HE2' ' B' ' 72' ' ' TYR . 19.9 t0 -96.16 169.24 10.09 Favored 'General case' 0 C--O 1.27 2.15 0 CA-C-O 121.35 0.595 . . . . 39.159999999999997 111.092 -174.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' HIS . . . . . 0.806 ' HD2' ' O ' ' B' 2014 ' ' HOH . 17.5 t60 -72.28 157.08 38.37 Favored 'General case' 0 C--O 1.252 1.189 0 N-CA-C 106.793 -1.558 . . . . 45.93 106.793 172.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' TYR . . . . . 1.017 ' CE2' ' O ' ' B' 2015 ' ' HOH . 77.6 t80 -42.67 132.82 3.63 Favored 'General case' 0 C--O 1.243 0.761 0 CA-C-N 115.067 -0.969 . . . . 40.710000000000001 112.422 -175.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ASP . . . . . . . . . . . . . 17.4 t0 -147.44 128.38 14.48 Favored 'General case' 0 C--O 1.253 1.273 0 CA-C-O 121.392 0.615 . . . . 41.079999999999998 111.249 174.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ALA . . . . . . . . . . . . . . . -46.52 -51.36 15.57 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-O 121.889 0.852 . . . . 36.960000000000001 110.888 -173.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ARG . . . . . . . . . . . . . 48.0 mtm180 -65.05 -24.74 67.56 Favored 'General case' 0 C--O 1.218 -0.58 0 N-CA-C 115.289 1.588 . . . . 48.25 115.289 -169.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' TYR . . . . . 0.486 ' HE2' ' HB3' ' B' ' 66' ' ' ASP . 12.1 m-30 -68.23 -49.91 57.52 Favored 'General case' 0 N--CA 1.438 -1.061 0 CA-C-O 121.725 0.774 . . . . 31.199999999999999 111.431 179.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -72.0 -39.63 69.09 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 108.856 -0.794 . . . . 30.09 108.856 -175.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.64 -45.91 92.28 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.084 0.772 . . . . 33.469999999999999 113.084 171.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . -57.86 -50.91 61.53 Favored Glycine 0 N--CA 1.502 3.092 0 CA-C-O 119.556 -0.58 . . . . 28.879999999999999 112.598 174.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' LEU . . . . . . . . . . . . . 64.9 tp -61.83 -44.59 96.55 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 113.583 0.957 . . . . 24.100000000000001 113.583 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -63.58 -44.16 96.95 Favored Glycine 0 CA--C 1.536 1.406 0 N-CA-C 108.074 -2.01 . . . . 27.25 108.074 176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . -54.94 -44.0 73.91 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 115.762 1.764 . . . . 33.25 115.762 173.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' CYS . . . . . . . . . . . . . 91.9 m -60.03 -43.04 95.56 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.778 0.799 . . . . 34.439999999999998 113.031 174.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . 0.647 HH21 HE21 ' B' ' 60' ' ' GLN . 65.4 mtt180 -68.25 -38.04 81.37 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.566 -0.743 . . . . 34.770000000000003 110.537 -172.446 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -59.93 -51.86 67.88 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.548 0.739 . . . . 39.409999999999997 110.962 173.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' SER . . . . . . . . . . . . . 49.3 m -54.16 -25.92 25.13 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 114.095 1.146 . . . . 38.5 114.095 172.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 9.6 mt -96.6 -0.1 49.15 Favored 'General case' 0 CA--C 1.553 1.062 0 N-CA-C 115.095 1.517 . . . . 36.939999999999998 115.095 177.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLY . . . . . . . . . . . . . . . 72.0 26.49 72.37 Favored Glycine 0 C--O 1.253 1.281 0 N-CA-C 111.374 -0.69 . . . . 35.520000000000003 111.374 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 23.6 mt -99.2 72.95 1.88 Allowed 'General case' 0 C--O 1.254 1.32 0 N-CA-C 103.928 -2.619 . . . . 35.090000000000003 103.928 174.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' TYR . . . . . . . . . . . . . 46.1 m-85 -76.4 -28.85 56.86 Favored 'General case' 0 C--O 1.211 -0.923 0 CA-C-N 115.109 -0.95 . . . . 43.729999999999997 108.984 -167.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' GLU . . . . . 0.589 ' HG3' ' O ' ' B' 2018 ' ' HOH . 4.1 mm-40 -68.54 -47.38 67.05 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.286 -0.415 . . . . 39.609999999999999 111.564 176.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 -68.03 -37.7 81.69 Favored 'General case' 0 CA--C 1.5 -0.952 0 O-C-N 122.99 0.181 . . . . 49.890000000000001 110.899 178.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ALA . . . . . . . . . . . . . . . -61.93 -45.08 95.25 Favored 'General case' 0 C--O 1.245 0.863 0 C-N-CA 118.221 -1.392 . . . . 23.23 112.346 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 22.3 tp -54.78 -42.74 72.11 Favored 'General case' 0 CA--C 1.564 1.519 0 CA-C-N 114.609 -1.178 . . . . 29.010000000000002 110.836 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -54.48 -52.27 62.44 Favored 'General case' 0 N--CA 1.486 1.358 0 O-C-N 121.988 -0.445 . . . . 37.859999999999999 110.927 171.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' SER . . . . . . . . . . . . . 5.1 m -55.41 -48.99 73.54 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 114.424 1.268 . . . . 25.859999999999999 114.424 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -63.89 -35.84 81.97 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 118.557 -0.735 . . . . 33.640000000000001 112.456 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' SER . . . . . . . . . . . . . 14.1 m -61.22 -48.32 82.02 Favored 'General case' 0 C--O 1.247 0.936 0 C-N-CA 118.565 -1.254 . . . . 26.129999999999999 113.001 179.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -62.02 -45.29 94.26 Favored 'General case' 0 CA--C 1.509 -0.614 0 CA-C-O 121.81 0.814 . . . . 27.510000000000002 111.624 172.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -49.88 -57.46 9.78 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 116.032 1.173 . . . . 25.57 116.032 172.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -54.6 -41.82 70.38 Favored 'General case' 0 C--O 1.265 1.878 0 C-N-CA 123.893 0.877 . . . . 26.600000000000001 111.193 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LEU . . . . . . . . . . . . . 29.5 tp -59.3 -40.47 86.31 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-N 115.059 -0.973 . . . . 28.960000000000001 112.754 -179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' MET . . . . . . . . . . . . . 10.3 mmt -94.14 -10.63 32.58 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 123.334 0.654 . . . . 37.049999999999997 112.556 -173.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' ASP . . . . . . . . . . . . . 64.2 t0 -143.06 75.83 1.5 Allowed 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.519 -0.919 . . . . 40.920000000000002 108.519 -176.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ILE . . . . . . . . . . . . . 10.9 pt -70.45 -16.27 19.74 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 N-CA-C 115.389 1.626 . . . . 35.770000000000003 115.389 -165.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASN . . . . . . . . . . . . 0.276 61.1 m-20 -94.7 0.03 54.7 Favored 'General case' 0 C--O 1.275 2.43 0 N-CA-C 115.963 1.838 . . . . 34.460000000000001 115.963 178.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -82.36 109.88 18.37 Favored Pre-proline 0 N--CA 1.474 0.753 0 N-CA-C 112.997 0.74 . . . . 36.0 112.997 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -72.59 -20.44 23.37 Favored 'Trans proline' 0 CA--C 1.505 -0.949 0 N-CA-C 115.195 1.19 . . . . 31.399999999999999 115.195 -173.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ARG . . . . . . . . . . . . . 82.8 mtm180 -68.44 -26.15 65.38 Favored 'General case' 0 C--O 1.177 -2.756 0 CA-C-O 117.671 -1.157 . . . . 42.740000000000002 113.672 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -64.02 -61.18 7.24 Favored Pre-proline 0 C--O 1.2 -1.549 0 N-CA-C 116.526 2.047 . . . . 26.780000000000001 116.526 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_endo -58.63 -32.13 96.11 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 115.86 -2.293 . . . . 26.140000000000001 115.372 174.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -59.86 -52.86 63.64 Favored 'General case' 0 C--O 1.241 0.629 0 O-C-N 121.063 -1.023 . . . . 42.479999999999997 111.267 177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -71.21 -30.49 66.43 Favored 'General case' 0 CA--C 1.487 -1.465 0 CA-C-O 118.546 -0.74 . . . . 34.039999999999999 111.587 179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.2 -37.3 86.88 Favored 'General case' 0 C--O 1.208 -1.081 0 N-CA-C 108.896 -0.779 . . . . 31.43 108.896 176.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' ALA . . . . . . . . . . . . . . . -63.35 -47.6 81.48 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.868 -0.79 . . . . 36.579999999999998 108.868 179.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLU . . . . . . . . . . . . . 76.6 mt-10 -47.13 -47.74 23.37 Favored 'General case' 0 N--CA 1.48 1.065 0 CA-C-O 118.071 -0.966 . . . . 46.170000000000002 112.009 173.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' CYS . . . . . . . . . . . . . 84.1 m -66.84 -36.16 81.7 Favored 'General case' 0 C--O 1.266 1.955 0 N-CA-C 115.406 1.632 . . . . 38.200000000000003 115.406 174.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' HIS . . . . . . . . . . . . . 25.8 m-70 -59.72 -38.97 83.15 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 107.776 -1.194 . . . . 36.159999999999997 107.776 176.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 2.0 mt -62.54 -57.88 9.56 Favored 'General case' 0 C--O 1.241 0.61 0 C-N-CA 123.455 0.702 . . . . 45.100000000000001 112.009 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' GLN . . . . . . . . . . . . . 50.2 mm-40 -52.82 -30.34 32.88 Favored 'General case' 0 C--O 1.216 -0.673 0 CA-C-N 115.295 -0.866 . . . . 47.0 112.061 171.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.48 4.35 28.21 Favored 'General case' 0 N--CA 1.474 0.767 0 O-C-N 121.515 -0.741 . . . . 47.18 111.266 176.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 52.0 43.3 55.5 Favored Glycine 0 N--CA 1.472 1.093 0 N-CA-C 116.859 1.504 . . . . 46.340000000000003 116.859 -169.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -116.46 87.56 2.71 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 105.712 -1.958 . . . . 49.75 105.712 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' LEU . . . . . . . . . . . . . 2.9 mt -76.64 -27.44 55.66 Favored 'General case' 0 C--O 1.21 -0.974 0 C-N-CA 118.338 -1.345 . . . . 48.049999999999997 111.573 -172.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 93.7 m-20 -56.57 -48.16 77.97 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-N 119.785 1.175 . . . . 47.799999999999997 108.152 169.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . -60.59 -45.37 96.45 Favored Glycine 0 C--N 1.343 0.933 0 O-C-N 123.237 0.336 . . . . 38.990000000000002 112.413 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -64.09 -39.98 95.24 Favored 'General case' 0 N--CA 1.441 -0.906 0 CA-C-O 121.161 0.505 . . . . 35.909999999999997 110.296 -176.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -64.7 -48.83 73.25 Favored 'General case' 0 CA--C 1.504 -0.799 0 N-CA-C 107.614 -1.254 . . . . 52.799999999999997 107.614 -171.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 2.3 m -54.04 -48.07 70.91 Favored 'General case' 0 CA--C 1.549 0.921 0 N-CA-C 116.407 2.003 . . . . 36.159999999999997 116.407 175.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . -67.42 -44.62 83.6 Favored Glycine 0 C--O 1.217 -0.966 0 N-CA-C 106.491 -2.644 . . . . 30.920000000000002 106.491 -175.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -66.25 -40.11 89.96 Favored 'General case' 0 N--CA 1.503 2.2 0 C-N-CA 118.64 -1.224 . . . . 38.079999999999998 110.967 -177.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' TYR . . . . . . . . . . . . . 42.0 t80 -60.34 -50.16 74.74 Favored 'General case' 0 N--CA 1.428 -1.542 0 CA-C-N 114.566 -1.197 . . . . 44.210000000000001 109.101 176.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' SER . . . . . . . . . . . . . 7.6 m -62.88 -41.39 99.39 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 119.312 -0.955 . . . . 33.950000000000003 111.272 178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.15 -46.37 89.9 Favored 'General case' 0 CA--C 1.478 -1.795 0 N-CA-C 107.684 -1.228 . . . . 33.079999999999998 107.684 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ARG . . . . . 0.429 ' NH1' HD23 ' B' ' 151' ' ' LEU . 59.7 ttp180 -58.33 -46.81 85.5 Favored 'General case' 0 N--CA 1.472 0.653 0 O-C-N 125.133 1.521 . . . . 47.899999999999999 111.818 -179.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ALA . . . . . . . . . . . . . . . -64.08 -38.69 91.97 Favored 'General case' 0 C--O 1.242 0.705 0 N-CA-C 114.966 1.469 . . . . 33.530000000000001 114.966 -177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 72.3 mt -66.69 -47.39 72.56 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 116.017 -0.538 . . . . 34.0 111.524 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' ALA . . . . . . . . . . . . . . . -63.11 -40.73 98.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 123.827 0.851 . . . . 35.509999999999998 112.236 -177.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ALA . . . . . . . . . . . . . . . -59.61 -29.0 67.68 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 112.532 0.568 . . . . 35.600000000000001 112.532 175.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -83.79 1.51 42.62 Favored 'General case' 0 CA--C 1.558 1.288 0 C-N-CA 118.404 -1.318 . . . . 38.390000000000001 114.263 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLN . . . . . 0.435 ' HA ' ' HD3' ' B' ' 138' ' ' PRO . 46.7 mt-30 -127.12 117.09 21.86 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 113.758 1.021 . . . . 53.270000000000003 113.758 -174.368 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' B' ' 137' ' ' GLN . 45.9 Cg_exo -61.03 -39.47 59.95 Favored 'Trans proline' 0 N--CA 1.478 0.595 0 N-CA-C 113.428 0.511 . . . . 46.460000000000001 113.428 -172.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -58.22 -32.89 68.73 Favored 'General case' 0 C--O 1.253 1.244 0 N-CA-C 113.865 1.061 . . . . 50.920000000000002 113.865 176.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' HIS . . . . . . . . . . . . . 91.2 m-70 -98.7 28.71 4.1 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 115.875 -0.602 . . . . 53.979999999999997 112.247 -177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -66.13 -42.26 89.38 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 119.342 -0.943 . . . . 58.310000000000002 113.122 -171.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' ALA . . . . . . . . . . . . . . . -55.16 -51.88 65.08 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 115.27 -0.877 . . . . 49.57 111.372 172.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' LEU . . . . . . . . . . . . . 59.7 tp -51.89 -40.38 60.57 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 113.953 1.094 . . . . 48.5 113.953 -175.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' ALA . . . . . . . . . . . . . . . -47.53 -33.58 6.57 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 113.769 1.025 . . . . 51.030000000000001 113.769 179.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ALA . . . . . . . . . . . . . . . -94.65 -16.45 23.14 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 116.735 2.124 . . . . 52.890000000000001 116.735 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' ARG . . . . . 0.655 ' HD3' ' O ' ' B' 2033 ' ' HOH . 0.3 OUTLIER -62.27 -41.69 98.68 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 117.267 -1.773 . . . . 59.350000000000001 108.319 163.051 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' ALA . . . . . . . . . . . . . . . -64.67 -53.5 46.42 Favored 'General case' 0 C--N 1.341 0.199 0 C-N-CA 123.565 0.746 . . . . 51.659999999999997 110.369 177.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . -47.09 -50.75 15.38 Favored Glycine 0 N--CA 1.475 1.286 0 O-C-N 124.644 1.215 . . . . 55.200000000000003 113.078 174.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' ALA . . . . . . . . . . . . . . . -67.67 -42.89 81.4 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 117.92 0.86 . . . . 56.93 110.76 -177.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' MET . . . . . . . . . . . . . 69.5 mmm -64.52 -36.54 84.53 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.245 -0.889 . . . . 62.729999999999997 111.936 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' LEU . . . . . 0.429 HD23 ' NH1' ' B' ' 131' ' ' ARG . 54.0 tp -56.83 -53.56 56.51 Favored 'General case' 0 CA--C 1.559 1.318 0 N-CA-C 112.872 0.693 . . . . 58.869999999999997 112.872 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLU . . . . . 0.7 ' HG2' ' O ' ' B' 2034 ' ' HOH . 70.1 mt-10 -53.92 -40.76 66.98 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 113.686 0.995 . . . . 70.150000000000006 113.686 175.116 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ALA . . . . . . . . . . . . . . . -51.04 -53.9 29.48 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.479 -0.328 . . . . 64.299999999999997 111.845 170.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' VAL . . . . . . . . . . . . . . . -63.12 -50.31 79.82 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 114.139 1.163 . . . . 63.82 114.139 -176.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' THR . . . . . . . . . . . . . 12.2 p -55.0 -13.53 1.16 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.322 1.23 . . . . 64.290000000000006 114.322 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.46 0 C-N-CA 122.811 0.444 . . . . 63.560000000000002 110.51 167.888 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ARG . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.502 2.145 0 N-CA-C 109.168 -0.679 . . . . 37.399999999999999 109.168 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' VAL . . . . . . . . . . . . . 81.9 t -80.44 137.39 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 CA-C-N 119.22 0.918 . . . . 33.539999999999999 110.574 173.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' GLU . . . . . 0.914 ' HG3' ' O ' ' C' 2002 ' ' HOH . 1.1 pm0 -93.47 111.94 23.73 Favored 'General case' 0 N--CA 1.438 -1.04 0 N-CA-C 107.307 -1.368 . . . . 38.280000000000001 107.307 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' LEU . . . . . . . . . . . . . 34.5 mt -81.89 150.12 27.93 Favored 'General case' 0 C--O 1.249 1.073 0 N-CA-C 113.868 1.062 . . . . 31.350000000000001 113.868 174.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-20 -56.04 133.78 52.09 Favored 'General case' 0 N--CA 1.503 2.195 0 CA-C-O 117.831 -1.081 . . . . 37.450000000000003 110.638 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.63 143.64 98.23 Favored Pre-proline 0 N--CA 1.489 1.505 0 N-CA-C 106.584 -1.635 . . . . 33.939999999999998 106.584 -179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' C' ' 55' ' ' ARG . 3.5 Cg_exo -72.53 -115.27 0.01 OUTLIER 'Trans proline' 0 C--N 1.362 1.258 0 N-CA-C 115.193 1.19 . . . . 42.369999999999997 115.193 178.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ARG . . . . . 0.782 ' CG ' ' O ' ' C' 2001 ' ' HOH . 1.6 tpm_? . . . . . 0 N--CA 1.507 2.423 0 C-N-CA 125.594 1.558 . . . . 55.640000000000001 114.76 -171.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1157 ' ' NO3 . . . . . 0.564 ' O3 ' ' HD2' ' A' ' 67' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . 0.408 ' O ' ' HG3' ' A' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2045 ' ' HOH . . . . . 0.51 ' O ' ' CD ' ' A' ' 141' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2047 ' ' HOH . . . . . 0.711 ' O ' ' CD ' ' A' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2001 ' ' HOH . . . . . 0.625 ' O ' ' HG3' ' B' ' 29' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2002 ' ' HOH . . . . . 1.158 ' O ' ' HA ' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2003 ' ' HOH . . . . . 1.127 ' O ' ' HG3' ' B' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2007 ' ' HOH . . . . . 0.508 ' O ' ' HB3' ' B' ' 45' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2014 ' ' HOH . . . . . 0.806 ' O ' ' HD2' ' B' ' 67' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2015 ' ' HOH . . . . . 1.017 ' O ' ' CE2' ' B' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2018 ' ' HOH . . . . . 0.589 ' O ' ' HG3' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2019 ' ' HOH . . . . . 0.456 ' O ' ' CD ' ' B' ' 87' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2031 ' ' HOH . . . . . 0.587 ' O ' ' HB2' ' B' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2033 ' ' HOH . . . . . 0.655 ' O ' ' HD3' ' B' ' 146' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2034 ' ' HOH . . . . . 0.7 ' O ' ' HG2' ' B' ' 152' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2001 ' ' HOH . . . . . 0.782 ' O ' ' CG ' ' C' ' 55' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 2002 ' ' HOH . . . . . 0.914 ' O ' ' HG3' ' C' ' 50' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_