data_6eeb_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6eeb _Structure_validation_residue.Date_analyzed 2019-08-02 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 ' 6' ' ' THR . . . . . . . . . . . . . 9.0 m . . . . . 0 C--O 1.231 0.129 0 N-CA-C 108.397 -0.964 . . . . 103.26 108.397 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -89.0 -36.33 15.88 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.468 -0.893 . . . . 108.83 111.045 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -19.02 44.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.361 -1.336 . . . . 103.57 112.876 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -60.53 -36.66 78.95 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.26 -0.976 . . . . 94.29 110.563 166.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 9.8 mm -67.33 -45.55 85.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.941 0.401 . . . . 68.19 110.407 174.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.12 93.33 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.359 -0.537 . . . . 58.2 111.468 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -53.25 -43.38 67.31 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.918 0.389 . . . . 87.51 110.937 167.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -71.69 -35.17 70.18 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.718 -0.219 . . . . 58.35 111.461 -172.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.95 -27.95 63.12 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 117.686 -1.606 . . . . 66.21 110.982 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -62.56 -48.74 78.15 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.431 -0.508 . . . . 77.28 110.616 171.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.51 -49.89 74.83 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.362 -0.381 . . . . 38.15 110.861 177.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -53.75 -46.18 70.82 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.771 0.285 . . . . 35.12 111.771 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.6 m -62.74 -40.44 97.22 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.654 -0.419 . . . . 53.44 111.4 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.2 mt -59.52 -48.32 82.11 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.16 -0.616 . . . . 60.35 111.08 176.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . 0.461 ' CD1' ' N ' ' A' ' 20' ' ' PHE . 3.7 m-30 -66.48 -37.28 84.74 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 120.368 -0.533 . . . . 58.67 110.899 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -80.3 81.35 6.57 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 107.003 -1.48 . . . . 44.83 107.003 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm -52.76 -49.21 65.97 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.064 -1.425 . . . . 83.39 111.947 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -91.25 3.69 54.22 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.786 0.661 . . . . 56.56 112.786 -171.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.69 13.41 71.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 116.17 1.228 . . . . 43.74 116.17 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -82.99 10.78 7.22 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.508 1.654 . . . . 51.2 112.968 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.51 4.27 89.13 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 115.874 1.11 . . . . 40.04 115.874 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 p -130.68 149.41 52.35 Favored 'General case' 0 C--N 1.34 0.176 0 CA-C-N 118.773 1.287 . . . . 50.37 110.21 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 78.7 mt -109.39 122.3 63.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.933 -1.136 . . . . 36.37 107.933 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 71.0 p -91.45 169.89 10.41 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.282 1.033 . . . . 47.23 110.705 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.3 p -56.55 -40.36 75.01 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.026 -0.67 . . . . 47.42 111.079 171.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.0 mptp? -65.3 -44.66 87.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.981 -0.688 . . . . 78.96 110.552 -176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -64.59 -40.43 95.5 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 120.106 -0.637 . . . . 46.03 110.463 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 tp -63.09 -44.54 95.44 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.915 -0.314 . . . . 45.18 110.559 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.6 -39.81 98.35 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.504 -0.855 . . . . 38.9 112.785 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.4 m -54.36 -45.74 72.85 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.176 -0.603 . . . . 50.24 111.285 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.04 -49.59 72.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.68 0.276 . . . . 48.4 110.734 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 90.7 mmm -54.51 -48.61 71.7 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.107 -0.637 . . . . 52.49 110.035 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 119.748 -0.781 . . . . 52.63 112.663 -176.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 p -67.79 -16.55 64.17 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.333 0.864 . . . . 50.06 113.333 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 mt -105.51 24.62 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 119.231 0.923 . . . . 61.99 113.163 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 17.46 73.65 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 115.404 0.922 . . . . 62.48 115.404 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -106.35 156.3 18.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.325 1.063 . . . . 77.37 109.754 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -130.72 61.71 60.9 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 115.468 -0.787 . . . . 77.04 110.091 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -71.96 144.79 43.74 Favored 'Trans proline' 0 CA--C 1.519 -0.273 0 CA-C-O 121.436 0.515 . . . . 48.49 110.961 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.4 p -72.5 168.6 18.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.785 -1.166 . . . . 50.38 109.913 174.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.19 -40.48 96.21 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 118.725 -1.19 . . . . 88.98 111.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.03 -40.6 77.03 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 120.059 -0.656 . . . . 44.27 111.426 175.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.36 -36.86 79.84 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.837 -0.539 . . . . 60.76 111.385 -179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 71.1 mt -66.88 -43.41 83.56 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.611 0.243 . . . . 41.49 111.093 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.39 -37.43 77.96 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.432 -0.507 . . . . 78.68 110.9 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.55 -47.62 80.83 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-O 118.211 -0.899 . . . . 81.42 110.949 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 90.5 mtp -54.39 -42.33 70.28 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.668 1.23 . . . . 49.17 110.618 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -71.3 -45.97 67.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 120.491 -0.484 . . . . 43.35 110.22 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -61.95 -29.5 70.28 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.278 -0.969 . . . . 54.25 111.643 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -62.3 -25.25 67.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.861 0.689 . . . . 65.83 112.861 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.4 m -120.83 7.69 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 CA-C-N 118.665 0.666 . . . . 39.19 112.023 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -85.59 76.31 10.02 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 122.117 0.961 . . . . 46.67 109.492 -167.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.05 78.96 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.288 -0.965 . . . . 38.21 111.917 -170.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -90.04 -7.5 53.73 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.26 -0.976 . . . . 53.83 112.971 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.39 23.61 73.04 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 116.238 1.255 . . . . 43.76 116.238 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -99.94 8.6 43.95 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.29 1.545 . . . . 50.95 113.453 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.17 -6.06 73.57 Favored Glycine 0 C--O 1.24 0.469 0 N-CA-C 116.05 1.18 . . . . 40.1 116.05 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.1 p -126.23 161.9 26.67 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.236 1.518 . . . . 42.38 109.375 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.0 mt -99.01 123.54 51.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.944 -0.761 . . . . 35.47 108.944 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.4 p30 -98.61 179.6 4.63 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.796 0.808 . . . . 48.96 108.845 167.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -64.5 -38.89 36.21 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 117.675 -1.61 . . . . 35.76 113.073 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -64.46 -40.15 25.5 Favored 'Trans proline' 0 N--CA 1.475 0.406 0 CA-C-N 120.172 1.097 . . . . 36.53 113.212 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 76.9 mt-10 -68.25 -27.86 66.71 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.285 0.493 . . . . 34.51 111.737 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -68.63 -33.61 74.31 Favored 'General case' 0 C--O 1.242 0.668 0 O-C-N 122.818 0.074 . . . . 33.96 110.991 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.25 -40.44 97.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.378 -0.529 . . . . 39.81 110.773 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 m -53.48 -47.22 70.01 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.371 0.605 . . . . 35.57 110.394 168.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 45.3 ttm -67.88 -42.35 81.36 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.65 -1.22 . . . . 49.14 111.099 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 38.0 mmt -64.96 -37.42 87.59 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.041 -0.264 . . . . 45.34 111.404 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -63.37 -23.59 67.48 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.96 -0.296 . . . . 63.57 110.352 168.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 4.3 ttp180 100.92 -1.91 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.568 2.747 . . . . 125.19 105.631 165.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -81.24 169.52 17.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 122.697 1.237 . . . . 72.84 113.628 -159.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 23.0 mmm -94.15 158.6 15.53 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.234 -1.348 . . . . 64.48 109.095 171.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -70.09 -31.11 68.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.636 -0.826 . . . . 51.35 112.901 -168.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -67.89 -45.88 73.21 Favored 'General case' 0 C--O 1.199 -1.591 0 N-CA-C 109.141 -0.689 . . . . 84.23 109.141 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.0 m -55.68 -48.05 75.72 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 124.468 1.105 . . . . 51.92 111.009 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -62.37 -42.25 99.26 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.714 -0.616 . . . . 33.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -66.26 -35.82 81.4 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.078 -0.649 . . . . 48.16 111.73 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.15 -42.69 99.51 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.76 -0.587 . . . . 64.72 111.262 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -64.61 -31.99 73.46 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.074 0.398 . . . . 67.05 112.074 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -76.48 -38.46 55.28 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.56 -0.456 . . . . 35.85 111.374 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.33 -37.92 81.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 C-N-CA 120.396 -0.522 . . . . 38.22 110.163 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -66.22 -33.67 76.28 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.614 -0.434 . . . . 63.33 111.666 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -66.86 -39.11 87.47 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.644 -0.823 . . . . 76.83 111.502 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.37 90.75 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.951 -0.7 . . . . 36.19 110.968 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -61.6 -42.22 98.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.822 -0.172 . . . . 37.25 111.152 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -69.38 -19.23 63.82 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.546 -0.861 . . . . 77.97 112.819 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 95.2 t -64.1 -41.44 92.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.77 -0.772 . . . . 37.81 110.413 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -79.41 -33.56 42.55 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.469 0.544 . . . . 46.17 112.469 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -81.76 70.28 8.62 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.364 1.078 . . . . 41.96 109.536 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.74 -45.03 86.41 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 114.783 -1.099 . . . . 37.64 112.379 -171.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 38.2 p30 -80.7 -11.16 59.67 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.266 -1.373 . . . . 51.84 112.211 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.17 18.33 72.12 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 115.686 1.035 . . . . 46.0 115.686 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -87.93 0.56 55.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.477 1.138 . . . . 48.88 113.415 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.78 2.64 58.42 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-O 119.211 -0.772 . . . . 42.54 114.809 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . . . . . . . . . 66.9 m-85 -137.13 135.7 37.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.296 1.048 . . . . 75.06 108.543 -177.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 74.3 mt -88.69 109.15 19.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 107.24 -1.393 . . . . 45.57 107.24 172.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 42.6 p -77.74 168.77 19.42 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.724 0.773 . . . . 40.28 110.24 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.22 -37.73 86.51 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.234 -0.587 . . . . 42.4 111.254 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.93 -41.83 77.56 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 120.529 -0.468 . . . . 39.76 110.697 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -60.99 -43.08 99.37 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 120.397 -0.521 . . . . 36.05 111.07 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.15 -45.14 93.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.798 -0.761 . . . . 47.75 111.309 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -63.58 -43.52 96.74 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.967 0.413 . . . . 51.99 111.259 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -62.92 -54.33 40.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 111.779 0.288 . . . . 40.14 111.779 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 72.9 t -64.21 -41.85 93.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.301 -0.559 . . . . 35.67 110.642 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.7 mmm -64.03 -41.45 97.41 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.988 -1.085 . . . . 55.47 110.991 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 55.1 m -56.7 -48.82 76.83 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.387 -0.525 . . . . 44.99 111.072 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -69.33 -16.9 63.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.145 -0.622 . . . . 38.26 112.273 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.7 mt -95.08 11.49 31.93 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 118.621 0.646 . . . . 53.17 112.487 173.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 98.86 -5.87 60.0 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 115.353 0.901 . . . . 52.38 115.353 171.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -108.37 106.7 16.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 118.293 1.046 . . . . 103.67 108.857 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -102.05 113.79 27.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.539 -1.282 . . . . 93.29 107.539 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.4 mp -99.97 162.52 12.93 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 79.29 108.573 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 5.8 p -70.87 175.11 5.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.096 0.95 . . . . 80.58 110.456 177.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -65.63 -36.37 83.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.244 -0.889 . . . . 82.82 112.026 177.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -87.41 -25.81 23.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.387 -0.925 . . . . 103.46 111.76 -173.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -53.07 -52.91 57.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.946 -0.702 . . . . 85.8 110.07 163.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.43 -48.71 86.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 116.093 -0.503 . . . . 74.4 110.437 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . 0.403 ' CB ' ' NH2' ' A' ' 127' ' ' ARG . 28.7 m-20 -60.04 -32.13 70.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.259 -0.577 . . . . 82.55 111.395 -178.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.05 -35.25 42.86 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.06 -0.656 . . . . 103.99 111.671 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 57.5 mtt -58.28 -43.38 87.98 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.761 -0.376 . . . . 77.61 111.469 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ILE . . . . . . . . . . . . . 3.1 mm -66.43 -44.67 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 108.446 -0.946 . . . . 66.48 108.446 178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ARG . . . . . 0.403 ' NH2' ' CB ' ' A' ' 123' ' ' ASP . 6.1 ttm180 -57.7 -55.86 29.44 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 125.034 1.458 . . . . 116.78 108.678 -178.866 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -49.9 -52.86 29.79 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 125.347 1.654 . . . . 86.3 111.301 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.97 -6.7 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.365 0.876 . . . . 69.8 113.365 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -76.94 92.66 3.69 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.361 -0.977 . . . . 73.81 108.361 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.1 mm -73.96 -55.68 11.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 C-N-CA 120.012 -0.675 . . . . 74.58 110.799 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -77.35 -0.99 27.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 113.484 0.92 . . . . 76.12 113.484 -173.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.06 18.06 80.2 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 117.209 1.643 . . . . 70.18 117.209 172.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.72 -0.89 52.74 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.848 1.324 . . . . 67.12 112.827 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.9 -2.85 76.79 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 115.502 0.961 . . . . 60.07 115.502 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -135.86 163.48 30.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.562 1.181 . . . . 71.17 109.082 -175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 96.5 t -108.22 112.39 40.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.544 -0.91 . . . . 48.8 108.544 -174.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 53.2 p30 -88.52 -177.12 5.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 122.253 1.025 . . . . 50.49 110.015 176.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -61.72 -52.19 65.31 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.185 -0.916 . . . . 51.66 111.441 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.33 -35.15 74.98 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.24 -0.984 . . . . 97.07 111.13 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -69.13 -37.5 78.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 119.98 -0.688 . . . . 63.85 111.211 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -60.82 -44.89 96.3 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 117.749 0.25 . . . . 50.35 111.445 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' VAL . . . . . . . . . . . . . 99.3 t -57.95 -43.35 84.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-O 121.07 0.462 . . . . 55.81 110.459 175.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -67.3 -44.95 77.97 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.818 -0.551 . . . . 96.73 111.477 -174.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' MET . . . . . . . . . . . . . 16.0 tmm? -48.61 -43.96 36.63 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 127.029 2.706 . . . . 90.37 106.728 -179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' MET . . . . . . . . . . . . . 2.0 mtp -87.65 -25.24 23.63 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 125.381 1.676 . . . . 98.23 111.523 -174.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' THR . . . . . . . . . . . . 0.333 5.2 m . . . . . 0 N--CA 1.491 1.587 0 O-C-N 126.941 2.651 . . . . 96.08 109.036 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' J6P . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . 0.488 ' HB ' ' HG3' ' A' ' 9' ' ' GLN . 9.0 m . . . . . 0 C--O 1.231 0.129 0 N-CA-C 108.397 -0.964 . . . . 103.26 108.397 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -89.0 -36.33 15.88 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.468 -0.893 . . . . 108.83 111.045 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -19.02 44.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.361 -1.336 . . . . 103.57 112.876 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . 0.488 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 11.7 mt-30 -60.53 -36.66 78.95 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.26 -0.976 . . . . 94.29 110.563 166.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 9.8 mm -67.33 -45.55 85.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.941 0.401 . . . . 68.19 110.407 174.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.12 93.33 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.359 -0.537 . . . . 58.2 111.468 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -53.25 -43.38 67.31 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.918 0.389 . . . . 87.51 110.937 167.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -71.69 -35.17 70.18 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.718 -0.219 . . . . 58.35 111.461 -172.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.95 -27.95 63.12 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 117.686 -1.606 . . . . 66.21 110.982 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -62.56 -48.74 78.15 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.431 -0.508 . . . . 77.28 110.616 171.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.51 -49.89 74.83 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.362 -0.381 . . . . 38.15 110.861 177.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -53.75 -46.18 70.82 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.771 0.285 . . . . 35.12 111.771 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.6 m -62.74 -40.44 97.22 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.654 -0.419 . . . . 53.44 111.4 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 19' ' ' LEU . 17.2 mt -59.52 -48.32 82.11 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.16 -0.616 . . . . 60.35 111.08 176.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . 0.461 ' CD1' ' N ' ' A' ' 20' ' ' PHE . 3.7 m-30 -66.48 -37.28 84.74 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 120.368 -0.533 . . . . 58.67 110.899 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -80.3 81.35 6.57 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 107.003 -1.48 . . . . 44.83 107.003 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm -52.76 -49.21 65.97 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.064 -1.425 . . . . 83.39 111.947 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -91.25 3.69 54.22 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.786 0.661 . . . . 56.56 112.786 -171.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.69 13.41 71.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 116.17 1.228 . . . . 43.74 116.17 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -82.99 10.78 7.22 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.508 1.654 . . . . 51.2 112.968 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.51 4.27 89.13 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 115.874 1.11 . . . . 40.04 115.874 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 p -130.68 149.41 52.35 Favored 'General case' 0 C--N 1.34 0.176 0 CA-C-N 118.773 1.287 . . . . 50.37 110.21 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 78.7 mt -109.39 122.3 63.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.933 -1.136 . . . . 36.37 107.933 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 71.0 p -91.45 169.89 10.41 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.282 1.033 . . . . 47.23 110.705 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.3 p -56.55 -40.36 75.01 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.026 -0.67 . . . . 47.42 111.079 171.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . 0.536 ' H ' ' HD2' ' A' ' 31' ' ' LYS . 2.0 mptp? -65.3 -44.66 87.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.981 -0.688 . . . . 78.96 110.552 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -64.59 -40.43 95.5 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 120.106 -0.637 . . . . 46.03 110.463 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 tp -63.09 -44.54 95.44 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.915 -0.314 . . . . 45.18 110.559 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.6 -39.81 98.35 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.504 -0.855 . . . . 38.9 112.785 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.4 m -54.36 -45.74 72.85 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.176 -0.603 . . . . 50.24 111.285 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.04 -49.59 72.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.68 0.276 . . . . 48.4 110.734 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 90.7 mmm -54.51 -48.61 71.7 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.107 -0.637 . . . . 52.49 110.035 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 119.748 -0.781 . . . . 52.63 112.663 -176.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 p -67.79 -16.55 64.17 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.333 0.864 . . . . 50.06 113.333 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 mt -105.51 24.62 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 119.231 0.923 . . . . 61.99 113.163 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 17.46 73.65 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 115.404 0.922 . . . . 62.48 115.404 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -106.35 156.3 18.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.325 1.063 . . . . 77.37 109.754 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -130.72 61.71 60.9 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 115.468 -0.787 . . . . 77.04 110.091 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -71.96 144.79 43.74 Favored 'Trans proline' 0 CA--C 1.519 -0.273 0 CA-C-O 121.436 0.515 . . . . 48.49 110.961 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.4 p -72.5 168.6 18.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.785 -1.166 . . . . 50.38 109.913 174.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.19 -40.48 96.21 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 118.725 -1.19 . . . . 88.98 111.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.03 -40.6 77.03 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 120.059 -0.656 . . . . 44.27 111.426 175.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.36 -36.86 79.84 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.837 -0.539 . . . . 60.76 111.385 -179.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 71.1 mt -66.88 -43.41 83.56 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.611 0.243 . . . . 41.49 111.093 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.39 -37.43 77.96 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.432 -0.507 . . . . 78.68 110.9 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.55 -47.62 80.83 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-O 118.211 -0.899 . . . . 81.42 110.949 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 90.5 mtp -54.39 -42.33 70.28 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.668 1.23 . . . . 49.17 110.618 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -71.3 -45.97 67.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 120.491 -0.484 . . . . 43.35 110.22 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -61.95 -29.5 70.28 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.278 -0.969 . . . . 54.25 111.643 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -62.3 -25.25 67.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.861 0.689 . . . . 65.83 112.861 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.4 m -120.83 7.69 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 CA-C-N 118.665 0.666 . . . . 39.19 112.023 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -85.59 76.31 10.02 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 122.117 0.961 . . . . 46.67 109.492 -167.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.05 78.96 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.288 -0.965 . . . . 38.21 111.917 -170.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -90.04 -7.5 53.73 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.26 -0.976 . . . . 53.83 112.971 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.39 23.61 73.04 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 116.238 1.255 . . . . 43.76 116.238 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -99.94 8.6 43.95 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.29 1.545 . . . . 50.95 113.453 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.17 -6.06 73.57 Favored Glycine 0 C--O 1.24 0.469 0 N-CA-C 116.05 1.18 . . . . 40.1 116.05 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.1 p -126.23 161.9 26.67 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.236 1.518 . . . . 42.38 109.375 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.0 mt -99.01 123.54 51.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.944 -0.761 . . . . 35.47 108.944 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.4 p30 -98.61 179.6 4.63 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.796 0.808 . . . . 48.96 108.845 167.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -64.5 -38.89 36.21 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 117.675 -1.61 . . . . 35.76 113.073 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -64.46 -40.15 25.5 Favored 'Trans proline' 0 N--CA 1.475 0.406 0 CA-C-N 120.172 1.097 . . . . 36.53 113.212 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 76.9 mt-10 -68.25 -27.86 66.71 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.285 0.493 . . . . 34.51 111.737 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -68.63 -33.61 74.31 Favored 'General case' 0 C--O 1.242 0.668 0 O-C-N 122.818 0.074 . . . . 33.96 110.991 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.25 -40.44 97.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.378 -0.529 . . . . 39.81 110.773 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 m -53.48 -47.22 70.01 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.371 0.605 . . . . 35.57 110.394 168.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MET . . . . . 0.49 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 45.3 ttm -67.88 -42.35 81.36 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.65 -1.22 . . . . 49.14 111.099 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 38.0 mmt -64.96 -37.42 87.59 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.041 -0.264 . . . . 45.34 111.404 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ARG . . . -63.37 -23.59 67.48 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.96 -0.296 . . . . 63.57 110.352 168.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 72' ' ' MET . 4.3 ttp180 100.92 -1.91 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.568 2.747 . . . . 125.19 105.631 165.81 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -81.24 169.52 17.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 122.697 1.237 . . . . 72.84 113.628 -159.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 23.0 mmm -94.15 158.6 15.53 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.234 -1.348 . . . . 64.48 109.095 171.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -70.09 -31.11 68.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.636 -0.826 . . . . 51.35 112.901 -168.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -67.89 -45.88 73.21 Favored 'General case' 0 C--O 1.199 -1.591 0 N-CA-C 109.141 -0.689 . . . . 84.23 109.141 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.0 m -55.68 -48.05 75.72 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 124.468 1.105 . . . . 51.92 111.009 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -62.37 -42.25 99.26 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.714 -0.616 . . . . 33.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -66.26 -35.82 81.4 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.078 -0.649 . . . . 48.16 111.73 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.15 -42.69 99.51 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.76 -0.587 . . . . 64.72 111.262 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -64.61 -31.99 73.46 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.074 0.398 . . . . 67.05 112.074 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -76.48 -38.46 55.28 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.56 -0.456 . . . . 35.85 111.374 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . 0.629 HG12 ' HE1' ' A' ' 146' ' ' MET . 68.8 mt -64.33 -37.92 81.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 C-N-CA 120.396 -0.522 . . . . 38.22 110.163 175.808 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -66.22 -33.67 76.28 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.614 -0.434 . . . . 63.33 111.666 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -66.86 -39.11 87.47 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.644 -0.823 . . . . 76.83 111.502 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.37 90.75 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.951 -0.7 . . . . 36.19 110.968 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -61.6 -42.22 98.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.822 -0.172 . . . . 37.25 111.152 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -69.38 -19.23 63.82 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.546 -0.861 . . . . 77.97 112.819 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 95.2 t -64.1 -41.44 92.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.77 -0.772 . . . . 37.81 110.413 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -79.41 -33.56 42.55 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.469 0.544 . . . . 46.17 112.469 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -81.76 70.28 8.62 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.364 1.078 . . . . 41.96 109.536 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.74 -45.03 86.41 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 114.783 -1.099 . . . . 37.64 112.379 -171.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 38.2 p30 -80.7 -11.16 59.67 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.266 -1.373 . . . . 51.84 112.211 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.17 18.33 72.12 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 115.686 1.035 . . . . 46.0 115.686 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -87.93 0.56 55.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.477 1.138 . . . . 48.88 113.415 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.78 2.64 58.42 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-O 119.211 -0.772 . . . . 42.54 114.809 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . 0.56 ' HB3' ' HB3' ' A' ' 136' ' ' GLN . 66.9 m-85 -137.13 135.7 37.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.296 1.048 . . . . 75.06 108.543 -177.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 74.3 mt -88.69 109.15 19.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 107.24 -1.393 . . . . 45.57 107.24 172.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 42.6 p -77.74 168.77 19.42 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.724 0.773 . . . . 40.28 110.24 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.22 -37.73 86.51 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.234 -0.587 . . . . 42.4 111.254 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.93 -41.83 77.56 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 120.529 -0.468 . . . . 39.76 110.697 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -60.99 -43.08 99.37 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 120.397 -0.521 . . . . 36.05 111.07 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.15 -45.14 93.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.798 -0.761 . . . . 47.75 111.309 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -63.58 -43.52 96.74 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.967 0.413 . . . . 51.99 111.259 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -62.92 -54.33 40.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 111.779 0.288 . . . . 40.14 111.779 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 72.9 t -64.21 -41.85 93.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.301 -0.559 . . . . 35.67 110.642 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.7 mmm -64.03 -41.45 97.41 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.988 -1.085 . . . . 55.47 110.991 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 55.1 m -56.7 -48.82 76.83 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.387 -0.525 . . . . 44.99 111.072 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -69.33 -16.9 63.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.145 -0.622 . . . . 38.26 112.273 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.7 mt -95.08 11.49 31.93 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 118.621 0.646 . . . . 53.17 112.487 173.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 98.86 -5.87 60.0 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 115.353 0.901 . . . . 52.38 115.353 171.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -108.37 106.7 16.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 118.293 1.046 . . . . 103.67 108.857 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -102.05 113.79 27.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.539 -1.282 . . . . 93.29 107.539 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.4 mp -99.97 162.52 12.93 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 79.29 108.573 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 0.475 HG23 ' OE1' ' A' ' 121' ' ' GLU . 5.8 p -70.87 175.11 5.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.096 0.95 . . . . 80.58 110.456 177.263 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -65.63 -36.37 83.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.244 -0.889 . . . . 82.82 112.026 177.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -87.41 -25.81 23.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.387 -0.925 . . . . 103.46 111.76 -173.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . 0.475 ' OE1' HG23 ' A' ' 118' ' ' THR . 47.1 mt-10 -53.07 -52.91 57.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.946 -0.702 . . . . 85.8 110.07 163.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.43 -48.71 86.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 116.093 -0.503 . . . . 74.4 110.437 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . 0.881 ' HB3' ' NH2' ' A' ' 127' ' ' ARG . 28.7 m-20 -60.04 -32.13 70.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.259 -0.577 . . . . 82.55 111.395 -178.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.05 -35.25 42.86 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.06 -0.656 . . . . 103.99 111.671 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 57.5 mtt -58.28 -43.38 87.98 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.761 -0.376 . . . . 77.61 111.469 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 137' ' ' VAL . 3.1 mm -66.43 -44.67 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 108.446 -0.946 . . . . 66.48 108.446 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ARG . . . . . 0.881 ' NH2' ' HB3' ' A' ' 123' ' ' ASP . 6.1 ttm180 -57.7 -55.86 29.44 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 125.034 1.458 . . . . 116.78 108.678 -178.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -49.9 -52.86 29.79 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 125.347 1.654 . . . . 86.3 111.301 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.97 -6.7 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.365 0.876 . . . . 69.8 113.365 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -76.94 92.66 3.69 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.361 -0.977 . . . . 73.81 108.361 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.1 mm -73.96 -55.68 11.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 C-N-CA 120.012 -0.675 . . . . 74.58 110.799 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -77.35 -0.99 27.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 113.484 0.92 . . . . 76.12 113.484 -173.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.06 18.06 80.2 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 117.209 1.643 . . . . 70.18 117.209 172.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.72 -0.89 52.74 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.848 1.324 . . . . 67.12 112.827 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.9 -2.85 76.79 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 115.502 0.961 . . . . 60.07 115.502 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' TYR . 48.4 mt-30 -135.86 163.48 30.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.562 1.181 . . . . 71.17 109.082 -175.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' VAL . . . . . 0.45 HG23 HD13 ' A' ' 126' ' ' ILE . 96.5 t -108.22 112.39 40.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.544 -0.91 . . . . 48.8 108.544 -174.476 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 314' ' ' HOH . 53.2 p30 -88.52 -177.12 5.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 122.253 1.025 . . . . 50.49 110.015 176.521 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -61.72 -52.19 65.31 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.185 -0.916 . . . . 51.66 111.441 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.33 -35.15 74.98 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.24 -0.984 . . . . 97.07 111.13 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -69.13 -37.5 78.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 119.98 -0.688 . . . . 63.85 111.211 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -60.82 -44.89 96.3 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 117.749 0.25 . . . . 50.35 111.445 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' VAL . . . . . 0.461 HG22 HG21 ' A' ' 86' ' ' ILE . 99.3 t -57.95 -43.35 84.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-O 121.07 0.462 . . . . 55.81 110.459 175.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -67.3 -44.95 77.97 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.818 -0.551 . . . . 96.73 111.477 -174.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' MET . . . . . 0.409 ' HE3' ' HG3' ' A' ' 146' ' ' MET . 16.0 tmm? -48.61 -43.96 36.63 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 127.029 2.706 . . . . 90.37 106.728 -179.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' MET . . . . . 0.629 ' HE1' HG12 ' A' ' 86' ' ' ILE . 2.0 mtp -87.65 -25.24 23.63 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 125.381 1.676 . . . . 98.23 111.523 -174.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' THR . . . . . . . . . . . . 0.333 5.2 m . . . . . 0 N--CA 1.491 1.587 0 O-C-N 126.941 2.651 . . . . 96.08 109.036 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' J6P . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . 0.424 ' O ' ' HB2' ' A' ' 138' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . 0.488 ' HB ' ' HG3' ' A' ' 9' ' ' GLN . 9.0 m . . . . . 0 C--O 1.231 0.129 0 N-CA-C 108.397 -0.964 . . . . 103.26000000000001 108.397 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -89.0 -36.33 15.88 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 119.468 -0.893 . . . . 108.83 111.045 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -81.13 -19.02 44.4 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.361 -1.336 . . . . 103.56999999999999 112.876 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.488 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 11.7 mt-30 -60.53 -36.66 78.95 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 119.26 -0.976 . . . . 94.290000000000006 110.563 166.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 9.8 mm -67.33 -45.55 85.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-O 120.941 0.401 . . . . 68.189999999999998 110.407 174.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.12 93.33 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.359 -0.537 . . . . 58.200000000000003 111.468 -177.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -53.25 -43.38 67.31 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-O 120.918 0.389 . . . . 87.510000000000005 110.937 167.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.0 m-30 -71.69 -35.17 70.18 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 116.718 -0.219 . . . . 58.350000000000001 111.461 -172.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 22.0 tptt -71.95 -27.95 63.12 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 117.686 -1.606 . . . . 66.209999999999994 110.982 174.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -62.56 -48.74 78.15 Favored 'General case' 0 C--O 1.24 0.589 0 C-N-CA 120.431 -0.508 . . . . 77.280000000000001 110.616 171.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.51 -49.89 74.83 Favored 'General case' 0 C--O 1.235 0.306 0 CA-C-N 116.362 -0.381 . . . . 38.149999999999999 110.861 177.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -53.75 -46.18 70.82 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 111.771 0.285 . . . . 35.119999999999997 111.771 -179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.6 m -62.74 -40.44 97.22 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.654 -0.419 . . . . 53.439999999999998 111.4 -178.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 19' ' ' LEU . 17.2 mt -59.52 -48.32 82.11 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.16 -0.616 . . . . 60.350000000000001 111.08 176.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.461 ' N ' ' CD1' ' A' ' 20' ' ' PHE . 3.7 m-30 -66.48 -37.28 84.74 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 120.368 -0.533 . . . . 58.670000000000002 110.899 -177.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -80.3 81.35 6.57 Favored 'General case' 0 C--O 1.238 0.473 0 N-CA-C 107.003 -1.48 . . . . 44.829999999999998 107.003 179.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 mmtm -52.76 -49.21 65.97 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.064 -1.425 . . . . 83.390000000000001 111.947 -174.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -91.25 3.69 54.22 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 112.786 0.661 . . . . 56.560000000000002 112.786 -171.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.69 13.41 71.64 Favored Glycine 0 N--CA 1.448 -0.539 0 N-CA-C 116.17 1.228 . . . . 43.740000000000002 116.17 171.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -82.99 10.78 7.22 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 119.508 1.654 . . . . 51.200000000000003 112.968 -176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 79.51 4.27 89.13 Favored Glycine 0 N--CA 1.449 -0.463 0 N-CA-C 115.874 1.11 . . . . 40.039999999999999 115.874 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 1.7 p -130.68 149.41 52.35 Favored 'General case' 0 C--N 1.34 0.176 0 CA-C-N 118.773 1.287 . . . . 50.369999999999997 110.21 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 78.7 mt -109.39 122.3 63.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.352 0 N-CA-C 107.933 -1.136 . . . . 36.369999999999997 107.933 174.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 71.0 p -91.45 169.89 10.41 Favored 'General case' 0 C--O 1.234 0.258 0 C-N-CA 124.282 1.033 . . . . 47.229999999999997 110.705 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.3 p -56.55 -40.36 75.01 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.026 -0.67 . . . . 47.420000000000002 111.079 171.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.536 ' HD2' ' H ' ' A' ' 31' ' ' LYS . 2.0 mptp? -65.3 -44.66 87.22 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 119.981 -0.688 . . . . 78.959999999999994 110.552 -176.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -64.59 -40.43 95.5 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 120.106 -0.637 . . . . 46.030000000000001 110.463 178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.7 tp -63.09 -44.54 95.44 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.915 -0.314 . . . . 45.18 110.559 177.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -62.6 -39.81 98.35 Favored Glycine 0 C--N 1.339 0.698 0 C-N-CA 120.504 -0.855 . . . . 38.899999999999999 112.785 -179.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 87.4 m -54.36 -45.74 72.85 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 122.176 -0.603 . . . . 50.240000000000002 111.285 175.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 58.4 t -67.04 -49.59 72.05 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-O 120.68 0.276 . . . . 48.399999999999999 110.734 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 90.7 mmm -54.51 -48.61 71.7 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.107 -0.637 . . . . 52.490000000000002 110.035 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 94.5 mtm-85 -66.18 -29.83 70.18 Favored 'General case' 0 N--CA 1.463 0.2 0 C-N-CA 119.748 -0.781 . . . . 52.630000000000003 112.663 -176.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.3 p -67.79 -16.55 64.17 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.333 0.864 . . . . 50.060000000000002 113.333 173.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 mt -105.51 24.62 11.88 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 119.231 0.923 . . . . 61.990000000000002 113.163 178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.4 17.46 73.65 Favored Glycine 0 N--CA 1.448 -0.565 0 N-CA-C 115.404 0.922 . . . . 62.479999999999997 115.404 174.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLN . . . . . . . . . . . . . 16.7 mm100 -106.35 156.3 18.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 118.325 1.063 . . . . 77.370000000000005 109.754 178.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -130.72 61.71 60.9 Favored Pre-proline 0 CA--C 1.531 0.246 0 CA-C-N 115.468 -0.787 . . . . 77.040000000000006 110.091 177.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -71.96 144.79 43.74 Favored 'Trans proline' 0 CA--C 1.519 -0.273 0 CA-C-O 121.436 0.515 . . . . 48.490000000000002 110.961 -178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 69.4 p -72.5 168.6 18.21 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 118.785 -1.166 . . . . 50.380000000000003 109.913 174.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -62.19 -40.48 96.21 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 118.725 -1.19 . . . . 88.980000000000004 111.447 173.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.03 -40.6 77.03 Favored 'General case' 0 C--O 1.245 0.846 0 C-N-CA 120.059 -0.656 . . . . 44.270000000000003 111.426 175.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -68.36 -36.86 79.84 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 121.837 -0.539 . . . . 60.759999999999998 111.385 -179.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 71.1 mt -66.88 -43.41 83.56 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 120.611 0.243 . . . . 41.490000000000002 111.093 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -59.39 -37.43 77.96 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.432 -0.507 . . . . 78.680000000000007 110.9 175.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.55 -47.62 80.83 Favored 'General case' 0 C--O 1.196 -1.745 0 CA-C-O 118.211 -0.899 . . . . 81.420000000000002 110.949 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 90.5 mtp -54.39 -42.33 70.28 Favored 'General case' 0 C--N 1.318 -0.766 0 O-C-N 124.668 1.23 . . . . 49.170000000000002 110.618 175.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.5 mt -71.3 -45.97 67.43 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.48 0 C-N-CA 120.491 -0.484 . . . . 43.350000000000001 110.22 -177.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -61.95 -29.5 70.28 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.278 -0.969 . . . . 54.25 111.643 -178.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 73.5 mt-10 -62.3 -25.25 67.76 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.861 0.689 . . . . 65.829999999999998 112.861 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 23.4 m -120.83 7.69 6.2 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.155 0 CA-C-N 118.665 0.666 . . . . 39.189999999999998 112.023 179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -85.59 76.31 10.02 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 122.117 0.961 . . . . 46.670000000000002 109.492 -167.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . -63.05 -35.05 78.96 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 119.288 -0.965 . . . . 38.210000000000001 111.917 -170.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.5 p-10 -90.04 -7.5 53.73 Favored 'General case' 0 C--O 1.235 0.291 0 C-N-CA 119.26 -0.976 . . . . 53.829999999999998 112.971 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 75.39 23.61 73.04 Favored Glycine 0 N--CA 1.447 -0.588 0 N-CA-C 116.238 1.255 . . . . 43.759999999999998 116.238 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 38.0 p-10 -99.94 8.6 43.95 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.29 1.545 . . . . 50.950000000000003 113.453 -176.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.17 -6.06 73.57 Favored Glycine 0 C--O 1.24 0.469 0 N-CA-C 116.05 1.18 . . . . 40.100000000000001 116.05 174.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 65.1 p -126.23 161.9 26.67 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 119.236 1.518 . . . . 42.380000000000003 109.375 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 17.0 mt -99.01 123.54 51.71 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.944 -0.761 . . . . 35.469999999999999 108.944 179.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.4 p30 -98.61 179.6 4.63 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.796 0.808 . . . . 48.960000000000001 108.845 167.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -64.5 -38.89 36.21 Favored Pre-proline 0 C--N 1.322 -0.607 0 C-N-CA 117.675 -1.61 . . . . 35.759999999999998 113.073 -172.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -64.46 -40.15 25.5 Favored 'Trans proline' 0 N--CA 1.475 0.406 0 CA-C-N 120.172 1.097 . . . . 36.530000000000001 113.212 177.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 76.9 mt-10 -68.25 -27.86 66.71 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 118.285 0.493 . . . . 34.509999999999998 111.737 175.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 87.4 t80 -68.63 -33.61 74.31 Favored 'General case' 0 C--O 1.242 0.668 0 O-C-N 122.818 0.074 . . . . 33.960000000000001 110.991 177.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.2 mt -63.25 -40.44 97.41 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.378 -0.529 . . . . 39.810000000000002 110.773 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 m -53.48 -47.22 70.01 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.371 0.605 . . . . 35.57 110.394 168.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MET . . . . . 0.49 ' O ' ' HA ' ' A' ' 75' ' ' ARG . 45.3 ttm -67.88 -42.35 81.36 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 118.65 -1.22 . . . . 49.140000000000001 111.099 -177.32 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 38.0 mmt -64.96 -37.42 87.59 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.041 -0.264 . . . . 45.340000000000003 111.404 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.429 ' O ' ' HB2' ' A' ' 75' ' ' ARG . . . -63.37 -23.59 67.48 Favored 'General case' 0 CA--C 1.519 -0.222 0 C-N-CA 120.96 -0.296 . . . . 63.57 110.352 168.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.49 ' HA ' ' O ' ' A' ' 72' ' ' MET . 4.3 ttp180 100.92 -1.91 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 128.568 2.747 . . . . 125.19 105.631 165.81 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.9 mtmp? -81.24 169.52 17.22 Favored 'General case' 0 CA--C 1.519 -0.227 0 CA-C-O 122.697 1.237 . . . . 72.840000000000003 113.628 -159.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 23.0 mmm -94.15 158.6 15.53 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.234 -1.348 . . . . 64.480000000000004 109.095 171.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 25.2 pttm -70.09 -31.11 68.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.636 -0.826 . . . . 51.350000000000001 112.901 -168.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 81.8 m-20 -67.89 -45.88 73.21 Favored 'General case' 0 C--O 1.199 -1.591 0 N-CA-C 109.141 -0.689 . . . . 84.230000000000004 109.141 -179.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 55.0 m -55.68 -48.05 75.72 Favored 'General case' 0 C--N 1.306 -1.321 0 O-C-N 124.468 1.105 . . . . 51.920000000000002 111.009 173.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -62.37 -42.25 99.26 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 121.714 -0.616 . . . . 33.0 110.904 179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 28.4 p -66.26 -35.82 81.4 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.078 -0.649 . . . . 48.159999999999997 111.73 -179.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 59.8 mt-10 -62.15 -42.69 99.51 Favored 'General case' 0 C--O 1.237 0.431 0 O-C-N 121.76 -0.587 . . . . 64.719999999999999 111.262 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -64.61 -31.99 73.46 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.074 0.398 . . . . 67.049999999999997 112.074 177.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 55.2 mt-10 -76.48 -38.46 55.28 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.56 -0.456 . . . . 35.850000000000001 111.374 178.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.629 HG12 ' HE1' ' A' ' 146' ' ' MET . 68.8 mt -64.33 -37.92 81.21 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 C-N-CA 120.396 -0.522 . . . . 38.219999999999999 110.163 175.808 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 52.3 ttm-85 -66.22 -33.67 76.28 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.614 -0.434 . . . . 63.329999999999998 111.666 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 84.5 mt-10 -66.86 -39.11 87.47 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 119.644 -0.823 . . . . 76.829999999999998 111.502 174.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.88 -38.37 90.75 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.951 -0.7 . . . . 36.189999999999998 110.968 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -61.6 -42.22 98.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 116.822 -0.172 . . . . 37.25 111.152 179.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 21.0 mtm180 -69.38 -19.23 63.82 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.546 -0.861 . . . . 77.969999999999999 112.819 -178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 95.2 t -64.1 -41.44 92.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 C-N-CA 119.77 -0.772 . . . . 37.810000000000002 110.413 172.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 89.8 m-85 -79.41 -33.56 42.55 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.469 0.544 . . . . 46.170000000000002 112.469 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 44.0 t0 -81.76 70.28 8.62 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-O 122.364 1.078 . . . . 41.960000000000001 109.536 -176.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -57.74 -45.03 86.41 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 114.783 -1.099 . . . . 37.640000000000001 112.379 -171.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 38.2 p30 -80.7 -11.16 59.67 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.266 -1.373 . . . . 51.840000000000003 112.211 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 80.17 18.33 72.12 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 115.686 1.035 . . . . 46.0 115.686 170.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 51.9 p-10 -87.93 0.56 55.72 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 118.477 1.138 . . . . 48.880000000000003 113.415 -175.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 97.78 2.64 58.42 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-O 119.211 -0.772 . . . . 42.539999999999999 114.809 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.56 ' HB3' ' HB3' ' A' ' 136' ' ' GLN . 66.9 m-85 -137.13 135.7 37.62 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 118.296 1.048 . . . . 75.060000000000002 108.543 -177.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 74.3 mt -88.69 109.15 19.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 N-CA-C 107.24 -1.393 . . . . 45.57 107.24 172.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 42.6 p -77.74 168.77 19.42 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 121.724 0.773 . . . . 40.280000000000001 110.24 173.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -62.22 -37.73 86.51 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.234 -0.587 . . . . 42.399999999999999 111.254 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -68.93 -41.83 77.56 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 120.529 -0.468 . . . . 39.759999999999998 110.697 -179.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -60.99 -43.08 99.37 Favored 'General case' 0 CA--C 1.52 -0.176 0 C-N-CA 120.397 -0.521 . . . . 36.049999999999997 111.07 174.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 49.2 tp -63.15 -45.14 93.27 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 119.798 -0.761 . . . . 47.75 111.309 179.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 56.6 ttp180 -63.58 -43.52 96.74 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.967 0.413 . . . . 51.990000000000002 111.259 179.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -62.92 -54.33 40.21 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 111.779 0.288 . . . . 40.140000000000001 111.779 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 72.9 t -64.21 -41.85 93.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.265 0 C-N-CA 120.301 -0.559 . . . . 35.670000000000002 110.642 -177.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 77.7 mmm -64.03 -41.45 97.41 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.988 -1.085 . . . . 55.469999999999999 110.991 -177.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 55.1 m -56.7 -48.82 76.83 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.387 -0.525 . . . . 44.990000000000002 111.072 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -69.33 -16.9 63.64 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 120.145 -0.622 . . . . 38.259999999999998 112.273 -176.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 81.7 mt -95.08 11.49 31.93 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 118.621 0.646 . . . . 53.170000000000002 112.487 173.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 98.86 -5.87 60.0 Favored Glycine 0 N--CA 1.448 -0.529 0 N-CA-C 115.353 0.901 . . . . 52.380000000000003 115.353 171.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -108.37 106.7 16.96 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 118.293 1.046 . . . . 103.67 108.857 178.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 8.0 ttmt -102.05 113.79 27.35 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.539 -1.282 . . . . 93.290000000000006 107.539 172.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 1.4 mp -99.97 162.52 12.93 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.573 -0.899 . . . . 79.290000000000006 108.573 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 0.475 HG23 ' OE1' ' A' ' 121' ' ' GLU . 5.8 p -70.87 175.11 5.31 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 122.096 0.95 . . . . 80.579999999999998 110.456 177.263 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -65.63 -36.37 83.52 Favored 'General case' 0 C--O 1.237 0.446 0 CA-C-N 115.244 -0.889 . . . . 82.819999999999993 112.026 177.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -87.41 -25.81 23.61 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.387 -0.925 . . . . 103.45999999999999 111.76 -173.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.475 ' OE1' HG23 ' A' ' 118' ' ' THR . 47.1 mt-10 -53.07 -52.91 57.04 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.946 -0.702 . . . . 85.799999999999997 110.07 163.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 28.1 t -59.43 -48.71 86.2 Favored 'Isoleucine or valine' 0 C--O 1.237 0.421 0 CA-C-N 116.093 -0.503 . . . . 74.400000000000006 110.437 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . 0.881 ' HB3' ' NH2' ' A' ' 127' ' ' ARG . 28.7 m-20 -60.04 -32.13 70.61 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.259 -0.577 . . . . 82.549999999999997 111.395 -178.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.05 -35.25 42.86 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.06 -0.656 . . . . 103.98999999999999 111.671 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . . 57.5 mtt -58.28 -43.38 87.98 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 120.761 -0.376 . . . . 77.609999999999999 111.469 173.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 137' ' ' VAL . 3.1 mm -66.43 -44.67 90.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 108.446 -0.946 . . . . 66.480000000000004 108.446 178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ARG . . . . . 0.881 ' NH2' ' HB3' ' A' ' 123' ' ' ASP . 6.1 ttm180 -57.7 -55.86 29.44 Favored 'General case' 0 C--O 1.208 -1.099 0 O-C-N 125.034 1.458 . . . . 116.78 108.678 -178.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -49.9 -52.86 29.79 Favored 'General case' 0 C--O 1.207 -1.15 0 O-C-N 125.347 1.654 . . . . 86.299999999999997 111.301 -178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -84.97 -6.7 59.33 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.365 0.876 . . . . 69.799999999999997 113.365 -175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -76.94 92.66 3.69 Favored 'General case' 0 N--CA 1.464 0.238 0 N-CA-C 108.361 -0.977 . . . . 73.810000000000002 108.361 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ILE . . . . . . . . . . . . . 12.1 mm -73.96 -55.68 11.55 Favored 'Isoleucine or valine' 0 C--O 1.239 0.525 0 C-N-CA 120.012 -0.675 . . . . 74.579999999999998 110.799 -178.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 30.4 p30 -77.35 -0.99 27.71 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 113.484 0.92 . . . . 76.120000000000005 113.484 -173.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLY . . . . . . . . . . . . . . . 75.06 18.06 80.2 Favored Glycine 0 C--O 1.237 0.342 0 N-CA-C 117.209 1.643 . . . . 70.180000000000007 117.209 172.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -83.72 -0.89 52.74 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.848 1.324 . . . . 67.120000000000005 112.827 178.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 91.9 -2.85 76.79 Favored Glycine 0 N--CA 1.445 -0.717 0 N-CA-C 115.502 0.961 . . . . 60.07 115.502 177.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLN . . . . . 0.56 ' HB3' ' HB3' ' A' ' 100' ' ' TYR . 48.4 mt-30 -135.86 163.48 30.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 118.562 1.181 . . . . 71.170000000000002 109.082 -175.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.45 HG23 HD13 ' A' ' 126' ' ' ILE . 96.5 t -108.22 112.39 40.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.328 0 N-CA-C 108.544 -0.91 . . . . 48.799999999999997 108.544 -174.476 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.424 ' HB2' ' O ' ' A' ' 314' ' ' HOH . 53.2 p30 -88.52 -177.12 5.52 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 122.253 1.025 . . . . 50.490000000000002 110.015 176.521 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -61.72 -52.19 65.31 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.185 -0.916 . . . . 51.659999999999997 111.441 -172.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 25.1 mm-40 -60.33 -35.15 74.98 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 119.24 -0.984 . . . . 97.069999999999993 111.13 -177.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -69.13 -37.5 78.35 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 119.98 -0.688 . . . . 63.850000000000001 111.211 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 70.8 t80 -60.82 -44.89 96.3 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 117.749 0.25 . . . . 50.350000000000001 111.445 174.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' VAL . . . . . 0.461 HG22 HG21 ' A' ' 86' ' ' ILE . 99.3 t -57.95 -43.35 84.58 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 CA-C-O 121.07 0.462 . . . . 55.810000000000002 110.459 175.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 2.4 tp-100 -67.3 -44.95 77.97 Favored 'General case' 0 C--O 1.236 0.345 0 O-C-N 121.818 -0.551 . . . . 96.730000000000004 111.477 -174.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' MET . . . . . 0.409 ' HE3' ' HG3' ' A' ' 146' ' ' MET . 16.0 tmm? -48.61 -43.96 36.63 Favored 'General case' 0 C--N 1.314 -0.956 0 O-C-N 127.029 2.706 . . . . 90.370000000000005 106.728 -179.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' MET . . . . . 0.629 ' HE1' HG12 ' A' ' 86' ' ' ILE . 2.0 mtp -87.65 -25.24 23.63 Favored 'General case' 0 N--CA 1.478 0.944 0 O-C-N 125.381 1.676 . . . . 98.230000000000004 111.523 -174.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' THR . . . . . . . . . . . . 0.333 5.2 m . . . . . 0 N--CA 1.491 1.587 0 O-C-N 126.941 2.651 . . . . 96.079999999999998 109.036 -178.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' J6P . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . 0.424 ' O ' ' HB2' ' A' ' 138' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 355' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 356' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 357' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 359' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 360' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 361' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_