data_4nkj_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4nkj _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.496 0.189 . . . . 83.319999999999993 110.638 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.82 168.71 14.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.935 0.398 . . . . 83.760000000000005 110.946 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.49 132.32 50.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 78.120000000000005 110.124 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -59.31 134.7 57.24 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.37 -0.604 . . . . 78.680000000000007 109.37 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 65.2 tp -59.95 -63.92 1.13 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.406 -0.361 . . . . 82.530000000000001 111.246 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -48.91 -49.58 39.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 83.469999999999999 111.561 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.8 t -51.3 -55.85 16.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 77.019999999999996 111.463 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.9 m -58.45 -39.74 80.69 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.21 -0.45 . . . . 73.760000000000005 111.197 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.8 tp60 -59.63 -46.46 88.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 71.719999999999999 110.747 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.72 -32.75 72.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.205 -0.452 . . . . 70.719999999999999 110.83 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -56.11 25.23 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.135 -0.484 . . . . 65.599999999999994 109.835 176.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.8 pt -61.95 -34.83 64.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.61 . . . . 71.219999999999999 112.0 -178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -60.43 -43.58 96.65 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.93 0.395 . . . . 63.57 110.392 174.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -64.85 -36.72 85.27 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.708 0.632 . . . . 60.520000000000003 112.708 178.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.69 -41.29 82.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 119.99 -0.684 . . . . 52.82 112.15 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.2 m -62.88 -42.59 99.83 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.873 0.368 . . . . 54.189999999999998 111.295 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -63.82 -39.74 94.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.118 -0.492 . . . . 67.510000000000005 111.483 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -60.41 -40.99 93.0 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.116 0.484 . . . . 47.310000000000002 111.185 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.95 -45.85 80.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.793 -0.639 . . . . 45.329999999999998 111.992 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -63.43 -38.68 92.06 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.314 0.578 . . . . 50.350000000000001 112.414 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 t -60.36 -54.01 50.74 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.446 -0.797 . . . . 47.840000000000003 110.106 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 52.1 tp -56.31 -40.1 73.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.728 -0.669 . . . . 44.840000000000003 111.317 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.0 t -60.44 -51.55 68.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.333 0.587 . . . . 42.079999999999998 111.484 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -68.9 -36.64 78.29 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 113.476 0.917 . . . . 59.119999999999997 113.476 -177.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 95.4 mt -60.34 -37.23 79.99 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.902 -0.719 . . . . 42.390000000000001 110.332 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -42.77 80.54 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 116.269 -0.423 . . . . 47.939999999999998 111.685 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . 0.511 ' CG2' ' O ' ' A' ' 223' ' ' HOH . 20.0 m -62.42 -34.46 64.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 118.562 -1.255 . . . . 41.450000000000003 110.848 175.39 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -63.4 -41.7 98.75 Favored 'General case' 0 C--O 1.246 0.907 0 C-N-CA 118.649 -1.22 . . . . 46.799999999999997 111.896 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -59.94 -43.24 95.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.957 -0.697 . . . . 39.109999999999999 111.798 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.7 mt -61.93 -38.4 88.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.718 -0.674 . . . . 40.259999999999998 112.009 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -72.07 -32.48 67.11 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.459 -0.497 . . . . 33.380000000000003 111.588 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . 0.614 ' NH2' ' O ' ' A' ' 214' ' ' HOH . 54.0 ttm-85 -67.25 -49.97 62.36 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 120.384 -0.527 . . . . 60.890000000000001 110.555 175.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 17.8 mt -54.66 -43.72 72.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.991 -0.549 . . . . 37.359999999999999 111.377 174.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.4 t -57.98 -46.51 85.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.894 -0.593 . . . . 48.490000000000002 112.05 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -55.87 -47.39 79.52 Favored Glycine 0 C--O 1.244 0.719 0 C-N-CA 120.88 -0.676 . . . . 36.350000000000001 111.896 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.27 80.58 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.209 0.528 . . . . 39.219999999999999 111.836 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 12.6 tpp -60.53 -48.56 81.21 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.257 0.551 . . . . 62.950000000000003 110.168 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.18 -39.13 81.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.962 -0.563 . . . . 52.18 112.01 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 54.5 tt0 -59.2 -54.81 42.62 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 119.709 -0.796 . . . . 62.32 110.175 176.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.6 mt -47.51 -46.49 27.45 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.455 -0.498 . . . . 42.600000000000001 111.024 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -57.25 -48.28 79.25 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-O 121.257 0.551 . . . . 53.049999999999997 111.913 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . 0.408 ' ND2' ' NH2' ' A' ' 121' ' ' ARG . 88.7 m-20 -59.9 -45.96 90.85 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 112.536 0.569 . . . . 51.57 112.536 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -55.98 -43.41 77.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 120.674 -0.41 . . . . 60.049999999999997 110.476 177.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.6 mt -61.94 -47.13 94.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 112.778 0.658 . . . . 42.280000000000001 112.778 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.88 -42.6 89.87 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.614 0.721 . . . . 53.0 111.472 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -66.92 -39.37 87.36 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.455 -0.793 . . . . 68.459999999999994 112.812 -179.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 8.0 tp -62.4 -43.01 99.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.293 -0.412 . . . . 43.859999999999999 110.747 175.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -56.56 -47.35 79.66 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.428 0.632 . . . . 52.899999999999999 111.288 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -60.92 -38.06 84.46 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.531 0.682 . . . . 73.549999999999997 110.921 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.22 -44.11 95.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.98 -1.009 . . . . 42.549999999999997 110.277 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 67.8 t -62.8 -44.12 99.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 CA-C-N 115.582 -0.735 . . . . 39.329999999999998 112.544 177.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -54.03 -51.79 62.91 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.426 0.631 . . . . 50.93 111.145 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -67.6 -30.72 70.39 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.703 1.001 . . . . 62.229999999999997 113.703 -176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.12 -45.11 82.24 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.075 -0.713 . . . . 36.719999999999999 109.075 173.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.8 ttm-85 -51.02 -52.59 41.47 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.189 -0.46 . . . . 42.189999999999998 110.335 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.95 88.01 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.472 0.915 . . . . 46.229999999999997 113.472 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -53.06 -64.14 0.92 Allowed 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.667 0.746 . . . . 45.520000000000003 112.19 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.7 t -64.64 -44.75 89.45 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 113.38 0.881 . . . . 32.259999999999998 113.38 -172.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ILE . . . . . . . . . . . . . 49.4 mm -65.63 -39.83 86.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.047 0.451 . . . . 32.950000000000003 111.664 179.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 m -58.26 -49.76 75.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 51.289999999999999 110.996 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.9 p -68.38 -34.57 76.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 119.333 -0.947 . . . . 33.719999999999999 112.504 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . 0.473 ' NE2' ' O ' ' A' ' 204' ' ' HOH . 40.3 mt-30 -63.11 -41.45 99.35 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 119.55 -0.86 . . . . 31.949999999999999 110.82 174.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 43.3 mt -57.6 -48.44 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.745 -0.661 . . . . 39.829999999999998 110.751 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -58.15 -41.02 82.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.231 0.826 . . . . 57.950000000000003 113.231 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.79 -39.92 95.42 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.102 -1.039 . . . . 32.07 110.739 177.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.08 91.8 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.201 0.524 . . . . 35.350000000000001 112.213 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 38.9 t -63.68 -49.76 80.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 46.07 111.224 -179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.82 -46.51 42.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.049 -0.523 . . . . 34.090000000000003 110.985 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 71.4 mt -59.89 -47.55 85.3 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.469 0.544 . . . . 36.380000000000003 112.469 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.1 m -52.68 -53.02 53.21 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.132 0.491 . . . . 45.560000000000002 111.56 172.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -57.73 -34.63 69.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.103 0.779 . . . . 40.18 113.103 -176.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -64.53 -31.77 73.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.205 -0.598 . . . . 40.960000000000001 111.413 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.91 26.94 57.49 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 116.174 1.229 . . . . 39.950000000000003 116.174 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 11.4 pt -106.18 -6.81 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 117.613 0.706 . . . . 40.140000000000001 112.435 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 39.3 mm -93.74 93.77 4.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 107.284 -1.376 . . . . 43.159999999999997 107.284 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -104.62 -51.65 3.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 50.369999999999997 111.969 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.1 t -70.67 -37.32 73.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 52.659999999999997 111.855 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . 0.459 ' OE1' ' ND1' ' A' ' 84' ' ' HIS . 59.9 mm-40 -103.79 20.7 17.59 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.502 0.927 . . . . 45.880000000000003 113.502 -175.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -59.37 -39.87 84.69 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.364 1.246 . . . . 44.270000000000003 114.364 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -65.09 -40.52 94.73 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.545 0.688 . . . . 45.880000000000003 111.764 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HIS . . . . . 0.459 ' ND1' ' OE1' ' A' ' 81' ' ' GLU . 39.6 m170 -64.95 -36.08 83.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.466 -0.788 . . . . 42.409999999999997 109.764 178.098 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.67 -51.52 64.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.452 -0.34 . . . . 35.509999999999998 111.317 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.5 mt -51.09 -48.24 61.71 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.45 -0.5 . . . . 49.600000000000001 111.389 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.77 92.96 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.786 -0.643 . . . . 35.07 111.371 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.09 -43.03 99.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.039 -0.528 . . . . 35.32 110.493 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.62 -43.38 89.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.602 -0.439 . . . . 54.549999999999997 111.08 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 68.6 mtt85 -56.16 -51.73 66.94 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.376 0.51 . . . . 57.490000000000002 112.376 174.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -52.16 -49.71 63.25 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.044 0.45 . . . . 47.729999999999997 111.856 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 55.9 mt -59.05 -48.27 82.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.957 -0.565 . . . . 36.659999999999997 112.361 -178.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -36.02 71.83 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 119.884 -0.727 . . . . 62.420000000000002 109.741 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -67.27 -21.56 65.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.705 -0.68 . . . . 63.950000000000003 111.975 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 7.8 mtm -98.8 3.54 47.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 113.027 0.751 . . . . 43.520000000000003 113.027 -178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 12.1 mt -60.73 149.46 35.44 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.015 0.746 . . . . 55.090000000000003 113.015 -177.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . 0.48 ' CA ' ' NZ ' ' A' ' 111' ' ' LYS . . . -56.35 147.83 30.83 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.693 -0.685 . . . . 64.859999999999999 112.842 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_exo -60.87 61.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 123.944 3.096 . . . . 69.680000000000007 113.068 178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' SER . . . . . 0.417 ' N ' ' O ' ' A' ' 97' ' ' GLY . 72.5 m -166.24 175.28 8.44 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.008 0.744 . . . . 81.349999999999994 113.008 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.5 130.92 43.81 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 113.156 0.799 . . . . 84.849999999999994 113.156 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 5.1 p -147.92 136.78 15.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.828 -0.624 . . . . 89.230000000000004 110.478 -179.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -75.29 165.83 24.56 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.43 0.9 . . . . 99.640000000000001 113.43 -174.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 24.8 pt -45.89 155.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 113.545 0.942 . . . . 94.459999999999994 113.545 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -70.91 -58.56 5.64 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.709 -0.678 . . . . 83.849999999999994 112.995 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.6 p-10 -39.28 123.15 1.37 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.748 0.647 . . . . 91.810000000000002 112.748 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 79.48 -146.52 28.87 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 111.211 -0.756 . . . . 80.980000000000004 111.211 -174.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 57.3 p -107.54 166.09 10.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.683 0.278 . . . . 82.920000000000002 111.194 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -170.37 157.0 5.88 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 112.139 0.422 . . . . 80.459999999999994 112.139 -173.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . 0.536 ' CG ' ' N ' ' A' ' 110' ' ' THR . 39.3 tp10 -91.32 -178.49 5.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.896 -0.593 . . . . 81.109999999999999 109.826 175.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' THR . . . . . 0.536 ' N ' ' CG ' ' A' ' 109' ' ' GLU . 15.2 t -155.07 -163.22 1.51 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.059 0.392 . . . . 80.810000000000002 112.059 -176.377 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LYS . . . . . 0.48 ' NZ ' ' CA ' ' A' ' 97' ' ' GLY . 17.6 ttpt -66.22 145.63 55.56 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.845 1.424 . . . . 75.920000000000002 114.845 -172.132 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.53 115.52 2.82 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.01 -0.541 . . . . 81.959999999999994 111.829 172.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 51.7 mtmt -149.05 69.08 1.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 114.844 1.424 . . . . 76.959999999999994 114.844 -174.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 12.4 t 170.39 102.18 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.494 0.553 . . . . 83.469999999999999 112.494 -179.21 -165.527 -113.746 110.292 101.471 2.033 82.919 107.501 -169.259 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -124.28 155.6 38.36 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.562 1.69 . . . . 82.530000000000001 115.562 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 67.35 -94.42 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.029 -0.987 . . . . 83.560000000000002 113.557 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' THR . . . . . 0.495 ' O ' ' N ' ' A' ' 121' ' ' ARG . 1.8 p -60.02 -23.75 63.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.365 -0.379 . . . . 82.170000000000002 111.347 -179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' CYS . . . . . . . . . . . . . 24.1 t -51.91 -42.19 62.57 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.951 -0.759 . . . . 82.680000000000007 108.951 174.769 -169.259 107.501 110.292 82.919 2.033 101.471 -113.746 -165.527 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 6.8 tt -102.02 -2.19 30.15 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.487 -0.779 . . . . 86.719999999999999 111.3 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -111.93 -33.72 6.2 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.479 0.548 . . . . 84.989999999999995 112.479 -173.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . 0.495 ' N ' ' O ' ' A' ' 117' ' ' THR . 13.0 mmt180 -64.38 -53.44 48.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.087 0.402 . . . . 77.560000000000002 112.087 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ILE . . . . . . . . . . . . . 2.3 mt -89.0 -43.16 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 113.51 0.93 . . . . 80.540000000000006 113.51 -173.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -75.88 100.63 4.87 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.463 0.542 . . . . 86.519999999999996 112.463 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.02 67.57 0.41 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.839 0.681 . . . . 90.459999999999994 112.839 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -130.48 113.38 1.42 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.373 -0.376 . . . . 85.359999999999999 112.925 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.9 m -59.04 116.21 3.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.177 0.436 . . . . 85.849999999999994 112.177 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -108.01 110.15 21.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.195 -0.457 . . . . 77.189999999999998 111.678 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -50.92 126.6 16.52 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.688 -0.687 . . . . 75.859999999999999 111.904 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.06 -141.43 0.02 OUTLIER 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.237 -0.438 . . . . 74.530000000000001 111.142 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -133.68 66.97 0.56 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 115.646 1.018 . . . . 70.549999999999997 115.646 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -91.68 95.25 9.79 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.217 -0.66 . . . . 81.349999999999994 109.217 169.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -112.83 138.34 49.82 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.898 0.38 . . . . 56.590000000000003 110.69 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 53.5 p -140.48 157.38 45.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.562 0.696 . . . . 54.969999999999999 111.28 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.2 mt -137.92 150.83 68.83 Favored Pre-proline 0 N--CA 1.445 -0.719 0 N-CA-C 106.444 -1.687 . . . . 51.219999999999999 106.444 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_endo -73.95 153.31 47.3 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 121.122 1.215 . . . . 51.810000000000002 112.046 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 31.7 p -112.85 157.06 21.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 106.952 -1.499 . . . . 57.439999999999998 106.952 164.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -128.78 155.79 44.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.533 0.568 . . . . 54.149999999999999 112.533 -170.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -98.52 155.47 17.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.881 -0.599 . . . . 76.480000000000004 110.248 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.8 t -91.73 145.94 24.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 66.709999999999994 110.503 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LEU . . . . . . . . . . . . . 60.6 mt -86.37 139.37 31.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.035 0.445 . . . . 71.0 112.073 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -80.41 105.43 11.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 80.239999999999995 110.207 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 15.0 pt -76.68 117.76 22.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.173 0.511 . . . . 76.620000000000005 110.064 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.9 p -93.53 138.54 31.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.981 -0.554 . . . . 78.260000000000005 111.601 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.62 152.64 44.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 80.239999999999995 111.209 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.059 -0.519 . . . . 85.379999999999995 111.683 178.938 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.473 ' O ' ' NE2' ' A' ' 65' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . 0.614 ' O ' ' NH2' ' A' ' 35' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . 0.511 ' O ' ' CG2' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . 0.422 ' O ' ' NH2' ' A' ' 35' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.496 0.189 . . . . 83.319999999999993 110.638 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.82 168.71 14.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.935 0.398 . . . . 83.760000000000005 110.946 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.49 132.32 50.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 78.120000000000005 110.124 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -59.31 134.7 57.24 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.37 -0.604 . . . . 78.680000000000007 109.37 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 65.2 tp -59.95 -63.92 1.13 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.406 -0.361 . . . . 82.530000000000001 111.246 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -48.91 -49.58 39.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 83.469999999999999 111.561 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.8 t -51.3 -55.85 16.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 77.019999999999996 111.463 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.9 m -58.45 -39.74 80.69 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.21 -0.45 . . . . 73.760000000000005 111.197 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' O ' HG12 ' A' ' 15' ' ' ILE . 28.8 tp60 -59.63 -46.46 88.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 71.719999999999999 110.747 178.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.72 -32.75 72.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.205 -0.452 . . . . 70.719999999999999 110.83 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 140' ' ' LEU . . . -60.65 -56.11 25.23 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.135 -0.484 . . . . 65.599999999999994 109.835 176.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 12' ' ' GLN . 17.8 pt -61.95 -34.83 64.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.61 . . . . 71.219999999999999 112.0 -178.919 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -60.43 -43.58 96.65 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.93 0.395 . . . . 63.57 110.392 174.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HD3' HD11 ' A' ' 140' ' ' LEU . 21.8 tttp -64.85 -36.72 85.27 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.708 0.632 . . . . 60.520000000000003 112.708 178.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.69 -41.29 82.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 119.99 -0.684 . . . . 52.82 112.15 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.2 m -62.88 -42.59 99.83 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.873 0.368 . . . . 54.189999999999998 111.295 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -63.82 -39.74 94.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.118 -0.492 . . . . 67.510000000000005 111.483 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -60.41 -40.99 93.0 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.116 0.484 . . . . 47.310000000000002 111.185 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.95 -45.85 80.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.793 -0.639 . . . . 45.329999999999998 111.992 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -63.43 -38.68 92.06 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.314 0.578 . . . . 50.350000000000001 112.414 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 t -60.36 -54.01 50.74 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.446 -0.797 . . . . 47.840000000000003 110.106 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 52.1 tp -56.31 -40.1 73.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.728 -0.669 . . . . 44.840000000000003 111.317 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.0 t -60.44 -51.55 68.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.333 0.587 . . . . 42.079999999999998 111.484 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' HG22 ' A' ' 30' ' ' VAL . 45.2 mt-10 -68.9 -36.64 78.29 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 113.476 0.917 . . . . 59.119999999999997 113.476 -177.945 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD13 ' HD3' ' A' ' 135' ' ' PRO . 95.4 mt -60.34 -37.23 79.99 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.902 -0.719 . . . . 42.390000000000001 110.332 172.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -42.77 80.54 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 116.269 -0.423 . . . . 47.939999999999998 111.685 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . 0.511 ' CG2' ' O ' ' A' ' 223' ' ' HOH . 20.0 m -62.42 -34.46 64.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 118.562 -1.255 . . . . 41.450000000000003 110.848 175.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -63.4 -41.7 98.75 Favored 'General case' 0 C--O 1.246 0.907 0 C-N-CA 118.649 -1.22 . . . . 46.799999999999997 111.896 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -59.94 -43.24 95.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.957 -0.697 . . . . 39.109999999999999 111.798 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.7 mt -61.93 -38.4 88.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.718 -0.674 . . . . 40.259999999999998 112.009 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -72.07 -32.48 67.11 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.459 -0.497 . . . . 33.380000000000003 111.588 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -67.25 -49.97 62.36 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 120.384 -0.527 . . . . 60.890000000000001 110.555 175.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 36' ' ' LEU . 17.8 mt -54.66 -43.72 72.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.991 -0.549 . . . . 37.359999999999999 111.377 174.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.4 t -57.98 -46.51 85.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.894 -0.593 . . . . 48.490000000000002 112.05 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -55.87 -47.39 79.52 Favored Glycine 0 C--O 1.244 0.719 0 C-N-CA 120.88 -0.676 . . . . 36.350000000000001 111.896 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.27 80.58 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.209 0.528 . . . . 39.219999999999999 111.836 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 12.6 tpp -60.53 -48.56 81.21 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.257 0.551 . . . . 62.950000000000003 110.168 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.18 -39.13 81.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.962 -0.563 . . . . 52.18 112.01 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HG3' ' NH1' ' A' ' 121' ' ' ARG . 54.5 tt0 -59.2 -54.81 42.62 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 119.709 -0.796 . . . . 62.32 110.175 176.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.6 mt -47.51 -46.49 27.45 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.455 -0.498 . . . . 42.600000000000001 111.024 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -57.25 -48.28 79.25 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-O 121.257 0.551 . . . . 53.049999999999997 111.913 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -59.9 -45.96 90.85 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 112.536 0.569 . . . . 51.57 112.536 177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . 0.497 ' HG2' ' HB3' ' A' ' 121' ' ' ARG . 97.9 mt-10 -55.98 -43.41 77.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 120.674 -0.41 . . . . 60.049999999999997 110.476 177.536 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.6 mt -61.94 -47.13 94.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 112.778 0.658 . . . . 42.280000000000001 112.778 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.88 -42.6 89.87 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.614 0.721 . . . . 53.0 111.472 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . 0.644 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 94.0 mt-10 -66.92 -39.37 87.36 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.455 -0.793 . . . . 68.459999999999994 112.812 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 54' ' ' VAL . 8.0 tp -62.4 -43.01 99.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.293 -0.412 . . . . 43.859999999999999 110.747 175.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -56.56 -47.35 79.66 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.428 0.632 . . . . 52.899999999999999 111.288 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 9.3 mm-40 -60.92 -38.06 84.46 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.531 0.682 . . . . 73.549999999999997 110.921 179.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.22 -44.11 95.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.98 -1.009 . . . . 42.549999999999997 110.277 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 50' ' ' LEU . 67.8 t -62.8 -44.12 99.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 CA-C-N 115.582 -0.735 . . . . 39.329999999999998 112.544 177.017 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -54.03 -51.79 62.91 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.426 0.631 . . . . 50.93 111.145 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASP . . . . . 0.438 ' OD2' ' HG2' ' A' ' 111' ' ' LYS . 83.8 m-20 -67.6 -30.72 70.39 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.703 1.001 . . . . 62.229999999999997 113.703 -176.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -66.12 -45.11 82.24 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.075 -0.713 . . . . 36.719999999999999 109.075 173.83 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.8 ttm-85 -51.02 -52.59 41.47 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.189 -0.46 . . . . 42.189999999999998 110.335 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.95 88.01 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.472 0.915 . . . . 46.229999999999997 113.472 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -53.06 -64.14 0.92 Allowed 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.667 0.746 . . . . 45.520000000000003 112.19 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.7 t -64.64 -44.75 89.45 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 113.38 0.881 . . . . 32.259999999999998 113.38 -172.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ILE . . . . . 0.577 HD12 ' HE3' ' A' ' 95' ' ' MET . 49.4 mm -65.63 -39.83 86.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.047 0.451 . . . . 32.950000000000003 111.664 179.647 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 m -58.26 -49.76 75.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 51.289999999999999 110.996 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.9 p -68.38 -34.57 76.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 119.333 -0.947 . . . . 33.719999999999999 112.504 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -63.11 -41.45 99.35 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 119.55 -0.86 . . . . 31.949999999999999 110.82 174.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 43.3 mt -57.6 -48.44 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.745 -0.661 . . . . 39.829999999999998 110.751 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -58.15 -41.02 82.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.231 0.826 . . . . 57.950000000000003 113.231 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.79 -39.92 95.42 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.102 -1.039 . . . . 32.07 110.739 177.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.08 91.8 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.201 0.524 . . . . 35.350000000000001 112.213 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.609 HG11 ' H ' ' A' ' 106' ' ' GLY . 38.9 t -63.68 -49.76 80.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 46.07 111.224 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.82 -46.51 42.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.049 -0.523 . . . . 34.090000000000003 110.985 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 71.4 mt -59.89 -47.55 85.3 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.469 0.544 . . . . 36.380000000000003 112.469 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.1 m -52.68 -53.02 53.21 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.132 0.491 . . . . 45.560000000000002 111.56 172.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -57.73 -34.63 69.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.103 0.779 . . . . 40.18 113.103 -176.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -64.53 -31.77 73.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.205 -0.598 . . . . 40.960000000000001 111.413 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.91 26.94 57.49 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 116.174 1.229 . . . . 39.950000000000003 116.174 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 11.4 pt -106.18 -6.81 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 117.613 0.706 . . . . 40.140000000000001 112.435 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 39.3 mm -93.74 93.77 4.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 107.284 -1.376 . . . . 43.159999999999997 107.284 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -104.62 -51.65 3.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 50.369999999999997 111.969 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.1 t -70.67 -37.32 73.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 52.659999999999997 111.855 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -103.79 20.7 17.59 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.502 0.927 . . . . 45.880000000000003 113.502 -175.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -59.37 -39.87 84.69 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.364 1.246 . . . . 44.270000000000003 114.364 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -65.09 -40.52 94.73 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.545 0.688 . . . . 45.880000000000003 111.764 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -64.95 -36.08 83.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.466 -0.788 . . . . 42.409999999999997 109.764 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.67 -51.52 64.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.452 -0.34 . . . . 35.509999999999998 111.317 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.5 mt -51.09 -48.24 61.71 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.45 -0.5 . . . . 49.600000000000001 111.389 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.77 92.96 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.786 -0.643 . . . . 35.07 111.371 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.09 -43.03 99.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.039 -0.528 . . . . 35.32 110.493 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.62 -43.38 89.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.602 -0.439 . . . . 54.549999999999997 111.08 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ARG . . . . . 0.699 ' HD2' ' O ' ' A' ' 211' ' ' HOH . 68.6 mtt85 -56.16 -51.73 66.94 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.376 0.51 . . . . 57.490000000000002 112.376 174.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -52.16 -49.71 63.25 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.044 0.45 . . . . 47.729999999999997 111.856 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . 0.556 HD23 ' CE ' ' A' ' 95' ' ' MET . 55.9 mt -59.05 -48.27 82.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.957 -0.565 . . . . 36.659999999999997 112.361 -178.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -36.02 71.83 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 119.884 -0.727 . . . . 62.420000000000002 109.741 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 94' ' ' LYS . 3.6 ttmt -67.27 -21.56 65.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.705 -0.68 . . . . 63.950000000000003 111.975 177.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . 0.577 ' HE3' HD12 ' A' ' 62' ' ' ILE . 7.8 mtm -98.8 3.54 47.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 113.027 0.751 . . . . 43.520000000000003 113.027 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.898 HD13 HG11 ' A' ' 101' ' ' VAL . 12.1 mt -60.73 149.46 35.44 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.015 0.746 . . . . 55.090000000000003 113.015 -177.71 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . 0.74 ' HA3' ' HZ3' ' A' ' 111' ' ' LYS . . . -56.35 147.83 30.83 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.693 -0.685 . . . . 64.859999999999999 112.842 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PRO . . . . . 0.459 ' HD2' ' NZ ' ' A' ' 111' ' ' LYS . 67.3 Cg_exo -60.87 61.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 123.944 3.096 . . . . 69.680000000000007 113.068 178.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' SER . . . . . 0.919 ' HB2' ' HB2' ' A' ' 111' ' ' LYS . 72.5 m -166.24 175.28 8.44 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.008 0.744 . . . . 81.349999999999994 113.008 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.5 130.92 43.81 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 113.156 0.799 . . . . 84.849999999999994 113.156 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.898 HG11 HD13 ' A' ' 96' ' ' LEU . 5.1 p -147.92 136.78 15.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.828 -0.624 . . . . 89.230000000000004 110.478 -179.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -75.29 165.83 24.56 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.43 0.9 . . . . 99.640000000000001 113.43 -174.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 24.8 pt -45.89 155.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 113.545 0.942 . . . . 94.459999999999994 113.545 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -70.91 -58.56 5.64 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.709 -0.678 . . . . 83.849999999999994 112.995 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . 0.523 ' HA ' HG11 ' A' ' 70' ' ' VAL . 2.6 p-10 -39.28 123.15 1.37 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.748 0.647 . . . . 91.810000000000002 112.748 -176.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLY . . . . . 0.609 ' H ' HG11 ' A' ' 70' ' ' VAL . . . 79.48 -146.52 28.87 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 111.211 -0.756 . . . . 80.980000000000004 111.211 -174.54 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 57.3 p -107.54 166.09 10.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.683 0.278 . . . . 82.920000000000002 111.194 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -170.37 157.0 5.88 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 112.139 0.422 . . . . 80.459999999999994 112.139 -173.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.656 ' HG3' ' N ' ' A' ' 110' ' ' THR . 39.3 tp10 -91.32 -178.49 5.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.896 -0.593 . . . . 81.109999999999999 109.826 175.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' THR . . . . . 0.656 ' N ' ' HG3' ' A' ' 109' ' ' GLU . 15.2 t -155.07 -163.22 1.51 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.059 0.392 . . . . 80.810000000000002 112.059 -176.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LYS . . . . . 0.919 ' HB2' ' HB2' ' A' ' 99' ' ' SER . 17.6 ttpt -66.22 145.63 55.56 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.845 1.424 . . . . 75.920000000000002 114.845 -172.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.53 115.52 2.82 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.01 -0.541 . . . . 81.959999999999994 111.829 172.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' A' ' 114' ' ' CYS . 51.7 mtmt -149.05 69.08 1.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 114.844 1.424 . . . . 76.959999999999994 114.844 -174.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' CYS . . . . . 0.699 ' HB2' ' HB3' ' A' ' 52' ' ' GLU . 12.4 t 170.39 102.18 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.494 0.553 . . . . 83.469999999999999 112.494 -179.21 -165.527 -113.746 110.292 101.471 2.033 82.919 107.501 -169.259 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -124.28 155.6 38.36 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.562 1.69 . . . . 82.530000000000001 115.562 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 67.35 -94.42 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.029 -0.987 . . . . 83.560000000000002 113.557 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' THR . . . . . 0.77 ' HA ' ' HB3' ' A' ' 120' ' ' ASP . 1.8 p -60.02 -23.75 63.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.365 -0.379 . . . . 82.170000000000002 111.347 -179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' A' ' 49' ' ' GLU . 24.1 t -51.91 -42.19 62.57 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.951 -0.759 . . . . 82.680000000000007 108.951 174.769 -169.259 107.501 110.292 82.919 2.033 101.471 -113.746 -165.527 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 6.8 tt -102.02 -2.19 30.15 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.487 -0.779 . . . . 86.719999999999999 111.3 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ASP . . . . . 0.77 ' HB3' ' HA ' ' A' ' 117' ' ' THR . 19.3 t0 -111.93 -33.72 6.2 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.479 0.548 . . . . 84.989999999999995 112.479 -173.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . 0.59 ' HG2' ' HB ' ' A' ' 117' ' ' THR . 13.0 mmt180 -64.38 -53.44 48.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.087 0.402 . . . . 77.560000000000002 112.087 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ILE . . . . . 0.484 HD12 ' O ' ' A' ' 225' ' ' HOH . 2.3 mt -89.0 -43.16 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 113.51 0.93 . . . . 80.540000000000006 113.51 -173.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -75.88 100.63 4.87 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.463 0.542 . . . . 86.519999999999996 112.463 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.02 67.57 0.41 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.839 0.681 . . . . 90.459999999999994 112.839 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -130.48 113.38 1.42 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.373 -0.376 . . . . 85.359999999999999 112.925 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.9 m -59.04 116.21 3.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.177 0.436 . . . . 85.849999999999994 112.177 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -108.01 110.15 21.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.195 -0.457 . . . . 77.189999999999998 111.678 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -50.92 126.6 16.52 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.688 -0.687 . . . . 75.859999999999999 111.904 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.06 -141.43 0.02 OUTLIER 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.237 -0.438 . . . . 74.530000000000001 111.142 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -133.68 66.97 0.56 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 115.646 1.018 . . . . 70.549999999999997 115.646 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -91.68 95.25 9.79 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.217 -0.66 . . . . 81.349999999999994 109.217 169.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -112.83 138.34 49.82 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.898 0.38 . . . . 56.590000000000003 110.69 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 53.5 p -140.48 157.38 45.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.562 0.696 . . . . 54.969999999999999 111.28 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.2 mt -137.92 150.83 68.83 Favored Pre-proline 0 N--CA 1.445 -0.719 0 N-CA-C 106.444 -1.687 . . . . 51.219999999999999 106.444 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' PRO . . . . . 0.42 ' HD3' HD13 ' A' ' 28' ' ' LEU . 99.0 Cg_endo -73.95 153.31 47.3 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 121.122 1.215 . . . . 51.810000000000002 112.046 -178.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 31.7 p -112.85 157.06 21.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 106.952 -1.499 . . . . 57.439999999999998 106.952 164.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' PHE . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 135' ' ' PRO . 49.0 m-85 -128.78 155.79 44.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.533 0.568 . . . . 54.149999999999999 112.533 -170.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -98.52 155.47 17.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.881 -0.599 . . . . 76.480000000000004 110.248 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.8 t -91.73 145.94 24.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 66.709999999999994 110.503 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 14' ' ' ALA . 60.6 mt -86.37 139.37 31.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.035 0.445 . . . . 71.0 112.073 178.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -80.41 105.43 11.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 80.239999999999995 110.207 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 15.0 pt -76.68 117.76 22.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.173 0.511 . . . . 76.620000000000005 110.064 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.9 p -93.53 138.54 31.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.981 -0.554 . . . . 78.260000000000005 111.601 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.62 152.64 44.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 80.239999999999995 111.209 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.059 -0.519 . . . . 85.379999999999995 111.683 178.938 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . 0.699 ' O ' ' HD2' ' A' ' 90' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . 0.511 ' O ' ' CG2' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . 0.484 ' O ' HD12 ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.1 t . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.496 0.189 . . . . 83.319999999999993 110.638 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -84.82 168.71 14.86 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.935 0.398 . . . . 83.760000000000005 110.946 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -104.49 132.32 50.87 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.201 -0.454 . . . . 78.120000000000005 110.124 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -59.31 134.7 57.24 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 109.37 -0.604 . . . . 78.680000000000007 109.37 178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 65.2 tp -59.95 -63.92 1.13 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.406 -0.361 . . . . 82.530000000000001 111.246 -178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -48.91 -49.58 39.34 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.236 -0.438 . . . . 83.469999999999999 111.561 -177.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 20.8 t -51.3 -55.85 16.14 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.242 -0.435 . . . . 77.019999999999996 111.463 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.9 m -58.45 -39.74 80.69 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.21 -0.45 . . . . 73.760000000000005 111.197 -179.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.466 ' O ' HG12 ' A' ' 15' ' ' ILE . 28.8 tp60 -59.63 -46.46 88.91 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.032 -0.531 . . . . 71.719999999999999 110.747 178.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -68.72 -32.75 72.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.205 -0.452 . . . . 70.719999999999999 110.83 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 140' ' ' LEU . . . -60.65 -56.11 25.23 Favored 'General case' 0 C--O 1.238 0.493 0 CA-C-N 116.135 -0.484 . . . . 65.599999999999994 109.835 176.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 12' ' ' GLN . 17.8 pt -61.95 -34.83 64.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 115.857 -0.61 . . . . 71.219999999999999 112.0 -178.919 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -60.43 -43.58 96.65 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.93 0.395 . . . . 63.57 110.392 174.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.429 ' HD3' HD11 ' A' ' 140' ' ' LEU . 21.8 tttp -64.85 -36.72 85.27 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 112.708 0.632 . . . . 60.520000000000003 112.708 178.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 45.9 mt -68.69 -41.29 82.52 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 C-N-CA 119.99 -0.684 . . . . 52.82 112.15 177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.2 m -62.88 -42.59 99.83 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-O 120.873 0.368 . . . . 54.189999999999998 111.295 176.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 tttm -63.82 -39.74 94.96 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.118 -0.492 . . . . 67.510000000000005 111.483 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -60.41 -40.99 93.0 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-O 121.116 0.484 . . . . 47.310000000000002 111.185 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 34.9 tp -65.95 -45.85 80.3 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 115.793 -0.639 . . . . 45.329999999999998 111.992 -179.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -63.43 -38.68 92.06 Favored 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.314 0.578 . . . . 50.350000000000001 112.414 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 40.8 t -60.36 -54.01 50.74 Favored 'General case' 0 C--O 1.244 0.789 0 CA-C-N 115.446 -0.797 . . . . 47.840000000000003 110.106 177.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 52.1 tp -56.31 -40.1 73.83 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.728 -0.669 . . . . 44.840000000000003 111.317 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.0 t -60.44 -51.55 68.98 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.333 0.587 . . . . 42.079999999999998 111.484 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' O ' HG22 ' A' ' 30' ' ' VAL . 45.2 mt-10 -68.9 -36.64 78.29 Favored 'General case' 0 C--O 1.249 1.054 0 N-CA-C 113.476 0.917 . . . . 59.119999999999997 113.476 -177.945 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.42 HD13 ' HD3' ' A' ' 135' ' ' PRO . 95.4 mt -60.34 -37.23 79.99 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.902 -0.719 . . . . 42.390000000000001 110.332 172.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.93 -42.77 80.54 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 116.269 -0.423 . . . . 47.939999999999998 111.685 -178.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.511 ' CG2' ' O ' ' A' ' 223' ' ' HOH . 20.0 m -62.42 -34.46 64.65 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 C-N-CA 118.562 -1.255 . . . . 41.450000000000003 110.848 175.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.1 mttm -63.4 -41.7 98.75 Favored 'General case' 0 C--O 1.246 0.907 0 C-N-CA 118.649 -1.22 . . . . 46.799999999999997 111.896 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -59.94 -43.24 95.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.957 -0.697 . . . . 39.109999999999999 111.798 176.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.7 mt -61.93 -38.4 88.28 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.718 -0.674 . . . . 40.259999999999998 112.009 178.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -72.07 -32.48 67.11 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 120.459 -0.497 . . . . 33.380000000000003 111.588 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 54.0 ttm-85 -67.25 -49.97 62.36 Favored 'General case' 0 C--O 1.247 0.933 0 C-N-CA 120.384 -0.527 . . . . 60.890000000000001 110.555 175.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 36' ' ' LEU . 17.8 mt -54.66 -43.72 72.65 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 115.991 -0.549 . . . . 37.359999999999999 111.377 174.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 44.4 t -57.98 -46.51 85.05 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.894 -0.593 . . . . 48.490000000000002 112.05 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . -55.87 -47.39 79.52 Favored Glycine 0 C--O 1.244 0.719 0 C-N-CA 120.88 -0.676 . . . . 36.350000000000001 111.896 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -60.51 -37.27 80.58 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.209 0.528 . . . . 39.219999999999999 111.836 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' MET . . . . . . . . . . . . . 12.6 tpp -60.53 -48.56 81.21 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-O 121.257 0.551 . . . . 62.950000000000003 110.168 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 97.7 m-20 -59.18 -39.13 81.58 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.962 -0.563 . . . . 52.18 112.01 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.445 ' HG3' ' NH1' ' A' ' 121' ' ' ARG . 54.5 tt0 -59.2 -54.81 42.62 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 119.709 -0.796 . . . . 62.32 110.175 176.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 84.6 mt -47.51 -46.49 27.45 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.455 -0.498 . . . . 42.600000000000001 111.024 175.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 -57.25 -48.28 79.25 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-O 121.257 0.551 . . . . 53.049999999999997 111.913 -179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.737 HD22 ' NH2' ' A' ' 121' ' ' ARG . 88.7 m-20 -59.9 -45.96 90.85 Favored 'General case' 0 C--O 1.239 0.549 0 N-CA-C 112.536 0.569 . . . . 51.57 112.536 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.497 ' HG2' ' HB3' ' A' ' 121' ' ' ARG . 97.9 mt-10 -55.98 -43.41 77.59 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 120.674 -0.41 . . . . 60.049999999999997 110.476 177.536 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 91.6 mt -61.94 -47.13 94.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 112.778 0.658 . . . . 42.280000000000001 112.778 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -58.88 -42.6 89.87 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 121.614 0.721 . . . . 53.0 111.472 178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.644 ' HB3' ' HA ' ' A' ' 118' ' ' CYS . 94.0 mt-10 -66.92 -39.37 87.36 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 115.455 -0.793 . . . . 68.459999999999994 112.812 -179.391 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.408 ' O ' HG23 ' A' ' 54' ' ' VAL . 8.0 tp -62.4 -43.01 99.84 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.293 -0.412 . . . . 43.859999999999999 110.747 175.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -56.56 -47.35 79.66 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.428 0.632 . . . . 52.899999999999999 111.288 176.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.699 ' HB3' ' HB2' ' A' ' 114' ' ' CYS . 9.3 mm-40 -60.92 -38.06 84.46 Favored 'General case' 0 C--O 1.244 0.807 0 CA-C-O 121.531 0.682 . . . . 73.549999999999997 110.921 179.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 69.9 tttt -60.22 -44.11 95.44 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 114.98 -1.009 . . . . 42.549999999999997 110.277 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 50' ' ' LEU . 67.8 t -62.8 -44.12 99.29 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 CA-C-N 115.582 -0.735 . . . . 39.329999999999998 112.544 177.017 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 85.6 m-20 -54.03 -51.79 62.91 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-O 121.426 0.631 . . . . 50.93 111.145 174.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASP . . . . . 0.438 ' OD2' ' HG2' ' A' ' 111' ' ' LYS . 83.8 m-20 -67.6 -30.72 70.39 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.703 1.001 . . . . 62.229999999999997 113.703 -176.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 57' ' ' LEU . 0.0 OUTLIER -66.12 -45.11 82.24 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 109.075 -0.713 . . . . 36.719999999999999 109.075 173.83 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 47.8 ttm-85 -51.02 -52.59 41.47 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 116.189 -0.46 . . . . 42.189999999999998 110.335 175.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -58.12 -44.95 88.01 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.472 0.915 . . . . 46.229999999999997 113.472 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 33.7 m-20 -53.06 -64.14 0.92 Allowed 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.667 0.746 . . . . 45.520000000000003 112.19 175.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.7 t -64.64 -44.75 89.45 Favored 'General case' 0 C--O 1.239 0.552 0 N-CA-C 113.38 0.881 . . . . 32.259999999999998 113.38 -172.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ILE . . . . . 0.577 HD12 ' HE3' ' A' ' 95' ' ' MET . 49.4 mm -65.63 -39.83 86.15 Favored 'Isoleucine or valine' 0 C--O 1.24 0.58 0 CA-C-O 121.047 0.451 . . . . 32.950000000000003 111.664 179.647 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 21.9 m -58.26 -49.76 75.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.15 -0.477 . . . . 51.289999999999999 110.996 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 2.9 p -68.38 -34.57 76.28 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 119.333 -0.947 . . . . 33.719999999999999 112.504 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 -63.11 -41.45 99.35 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 119.55 -0.86 . . . . 31.949999999999999 110.82 174.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 43.3 mt -57.6 -48.44 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.745 -0.661 . . . . 39.829999999999998 110.751 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 60.7 mt-10 -58.15 -41.02 82.84 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.231 0.826 . . . . 57.950000000000003 113.231 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.79 -39.92 95.42 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.102 -1.039 . . . . 32.07 110.739 177.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.28 -46.08 91.8 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-O 121.201 0.524 . . . . 35.350000000000001 112.213 177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.609 HG11 ' H ' ' A' ' 106' ' ' GLY . 38.9 t -63.68 -49.76 80.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 46.07 111.224 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 7.3 tt -48.82 -46.51 42.0 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.049 -0.523 . . . . 34.090000000000003 110.985 172.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 71.4 mt -59.89 -47.55 85.3 Favored 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.469 0.544 . . . . 36.380000000000003 112.469 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.1 m -52.68 -53.02 53.21 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 121.132 0.491 . . . . 45.560000000000002 111.56 172.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -57.73 -34.63 69.71 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 113.103 0.779 . . . . 40.18 113.103 -176.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.8 tp10 -64.53 -31.77 73.12 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 120.205 -0.598 . . . . 40.960000000000001 111.413 179.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 78.91 26.94 57.49 Favored Glycine 0 CA--C 1.525 0.671 0 N-CA-C 116.174 1.229 . . . . 39.950000000000003 116.174 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 11.4 pt -106.18 -6.81 10.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.198 0 CA-C-N 117.613 0.706 . . . . 40.140000000000001 112.435 -178.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 39.3 mm -93.74 93.77 4.24 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 N-CA-C 107.284 -1.376 . . . . 43.159999999999997 107.284 173.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 -104.62 -51.65 3.04 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.305 -0.407 . . . . 50.369999999999997 111.969 -176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 31.1 t -70.67 -37.32 73.65 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.277 -0.42 . . . . 52.659999999999997 111.855 -179.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -103.79 20.7 17.59 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 113.502 0.927 . . . . 45.880000000000003 113.502 -175.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -59.37 -39.87 84.69 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.364 1.246 . . . . 44.270000000000003 114.364 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -65.09 -40.52 94.73 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.545 0.688 . . . . 45.880000000000003 111.764 177.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 39.6 m170 -64.95 -36.08 83.25 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.466 -0.788 . . . . 42.409999999999997 109.764 178.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 27.5 tp -63.67 -51.52 64.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.452 -0.34 . . . . 35.509999999999998 111.317 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.5 mt -51.09 -48.24 61.71 Favored 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 120.45 -0.5 . . . . 49.600000000000001 111.389 175.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -59.51 -42.77 92.96 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.786 -0.643 . . . . 35.07 111.371 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.09 -43.03 99.51 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.039 -0.528 . . . . 35.32 110.493 178.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 82.7 mt-10 -58.62 -43.38 89.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.602 -0.439 . . . . 54.549999999999997 111.08 176.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.699 ' HD2' ' O ' ' A' ' 211' ' ' HOH . 68.6 mtt85 -56.16 -51.73 66.94 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.376 0.51 . . . . 57.490000000000002 112.376 174.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 42.0 mttp -52.16 -49.71 63.25 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-O 121.044 0.45 . . . . 47.729999999999997 111.856 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.556 HD23 ' CE ' ' A' ' 95' ' ' MET . 55.9 mt -59.05 -48.27 82.21 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.957 -0.565 . . . . 36.659999999999997 112.361 -178.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -57.89 -36.02 71.83 Favored 'General case' 0 C--N 1.331 -0.23 0 C-N-CA 119.884 -0.727 . . . . 62.420000000000002 109.741 177.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.419 ' HE3' ' HB2' ' A' ' 94' ' ' LYS . 3.6 ttmt -67.27 -21.56 65.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.705 -0.68 . . . . 63.950000000000003 111.975 177.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . 0.577 ' HE3' HD12 ' A' ' 62' ' ' ILE . 7.8 mtm -98.8 3.54 47.46 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 113.027 0.751 . . . . 43.520000000000003 113.027 -178.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.898 HD13 HG11 ' A' ' 101' ' ' VAL . 12.1 mt -60.73 149.46 35.44 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 113.015 0.746 . . . . 55.090000000000003 113.015 -177.71 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.74 ' HA3' ' HZ3' ' A' ' 111' ' ' LYS . . . -56.35 147.83 30.83 Favored Glycine 0 N--CA 1.448 -0.55 0 CA-C-N 115.693 -0.685 . . . . 64.859999999999999 112.842 179.122 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.459 ' HD2' ' NZ ' ' A' ' 111' ' ' LYS . 67.3 Cg_exo -60.87 61.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 123.944 3.096 . . . . 69.680000000000007 113.068 178.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' SER . . . . . 0.919 ' HB2' ' HB2' ' A' ' 111' ' ' LYS . 72.5 m -166.24 175.28 8.44 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 113.008 0.744 . . . . 81.349999999999994 113.008 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -69.5 130.92 43.81 Favored 'General case' 0 C--O 1.234 0.258 0 N-CA-C 113.156 0.799 . . . . 84.849999999999994 113.156 -176.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.898 HG11 HD13 ' A' ' 96' ' ' LEU . 5.1 p -147.92 136.78 15.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 115.828 -0.624 . . . . 89.230000000000004 110.478 -179.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASP . . . . . . . . . . . . . 21.3 t0 -75.29 165.83 24.56 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 113.43 0.9 . . . . 99.640000000000001 113.43 -174.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 24.8 pt -45.89 155.96 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 N-CA-C 113.545 0.942 . . . . 94.459999999999994 113.545 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -70.91 -58.56 5.64 Favored Glycine 0 N--CA 1.45 -0.415 0 CA-C-N 115.709 -0.678 . . . . 83.849999999999994 112.995 178.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.523 ' HA ' HG11 ' A' ' 70' ' ' VAL . 2.6 p-10 -39.28 123.15 1.37 Allowed 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 112.748 0.647 . . . . 91.810000000000002 112.748 -176.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.609 ' H ' HG11 ' A' ' 70' ' ' VAL . . . 79.48 -146.52 28.87 Favored Glycine 0 CA--C 1.519 0.339 0 N-CA-C 111.211 -0.756 . . . . 80.980000000000004 111.211 -174.54 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 57.3 p -107.54 166.09 10.92 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 120.683 0.278 . . . . 82.920000000000002 111.194 176.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -170.37 157.0 5.88 Favored 'General case' 0 C--O 1.233 0.207 0 N-CA-C 112.139 0.422 . . . . 80.459999999999994 112.139 -173.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.656 ' HG3' ' N ' ' A' ' 110' ' ' THR . 39.3 tp10 -91.32 -178.49 5.15 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.896 -0.593 . . . . 81.109999999999999 109.826 175.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' THR . . . . . 0.656 ' N ' ' HG3' ' A' ' 109' ' ' GLU . 15.2 t -155.07 -163.22 1.51 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.059 0.392 . . . . 80.810000000000002 112.059 -176.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LYS . . . . . 0.919 ' HB2' ' HB2' ' A' ' 99' ' ' SER . 17.6 ttpt -66.22 145.63 55.56 Favored 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 114.845 1.424 . . . . 75.920000000000002 114.845 -172.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -158.53 115.52 2.82 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 116.01 -0.541 . . . . 81.959999999999994 111.829 172.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . 0.564 ' O ' ' HB2' ' A' ' 114' ' ' CYS . 51.7 mtmt -149.05 69.08 1.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 114.844 1.424 . . . . 76.959999999999994 114.844 -174.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.699 ' HB2' ' HB3' ' A' ' 52' ' ' GLU . 12.4 t 170.39 102.18 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 112.494 0.553 . . . . 83.469999999999999 112.494 -179.21 -165.527 -113.746 110.292 101.471 2.033 82.919 107.501 -169.259 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -124.28 155.6 38.36 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 115.562 1.69 . . . . 82.530000000000001 115.562 -176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 39.5 tp60 67.35 -94.42 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.029 -0.987 . . . . 83.560000000000002 113.557 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' THR . . . . . 0.77 ' HA ' ' HB3' ' A' ' 120' ' ' ASP . 1.8 p -60.02 -23.75 63.95 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.365 -0.379 . . . . 82.170000000000002 111.347 -179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' CYS . . . . . 0.644 ' HA ' ' HB3' ' A' ' 49' ' ' GLU . 24.1 t -51.91 -42.19 62.57 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 108.951 -0.759 . . . . 82.680000000000007 108.951 174.769 -169.259 107.501 110.292 82.919 2.033 101.471 -113.746 -165.527 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 6.8 tt -102.02 -2.19 30.15 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.487 -0.779 . . . . 86.719999999999999 111.3 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ASP . . . . . 0.77 ' HB3' ' HA ' ' A' ' 117' ' ' THR . 19.3 t0 -111.93 -33.72 6.2 Favored 'General case' 0 N--CA 1.464 0.258 0 N-CA-C 112.479 0.548 . . . . 84.989999999999995 112.479 -173.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.737 ' NH2' HD22 ' A' ' 45' ' ' ASN . 13.0 mmt180 -64.38 -53.44 48.57 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.087 0.402 . . . . 77.560000000000002 112.087 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ILE . . . . . 0.484 HD12 ' O ' ' A' ' 225' ' ' HOH . 2.3 mt -89.0 -43.16 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 113.51 0.93 . . . . 80.540000000000006 113.51 -173.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -75.88 100.63 4.87 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.463 0.542 . . . . 86.519999999999996 112.463 179.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 67.02 67.57 0.41 Allowed 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 112.839 0.681 . . . . 90.459999999999994 112.839 178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . -130.48 113.38 1.42 Allowed Glycine 0 C--N 1.331 0.255 0 CA-C-N 116.373 -0.376 . . . . 85.359999999999999 112.925 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' THR . . . . . . . . . . . . . 33.9 m -59.04 116.21 3.67 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 112.177 0.436 . . . . 85.849999999999994 112.177 -177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' PHE . . . . . . . . . . . . . 45.2 t80 -108.01 110.15 21.79 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.195 -0.457 . . . . 77.189999999999998 111.678 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -50.92 126.6 16.52 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 115.688 -0.687 . . . . 75.859999999999999 111.904 176.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -77.06 -141.43 0.02 OUTLIER 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.237 -0.438 . . . . 74.530000000000001 111.142 -178.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLY . . . . . . . . . . . . . . . -133.68 66.97 0.56 Allowed Glycine 0 N--CA 1.449 -0.466 0 N-CA-C 115.646 1.018 . . . . 70.549999999999997 115.646 -175.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 45.5 tt0 -91.68 95.25 9.79 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.217 -0.66 . . . . 81.349999999999994 109.217 169.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -112.83 138.34 49.82 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-O 120.898 0.38 . . . . 56.590000000000003 110.69 178.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' SER . . . . . . . . . . . . . 53.5 p -140.48 157.38 45.6 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 121.562 0.696 . . . . 54.969999999999999 111.28 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LEU . . . . . . . . . . . . . 45.2 mt -137.92 150.83 68.83 Favored Pre-proline 0 N--CA 1.445 -0.719 0 N-CA-C 106.444 -1.687 . . . . 51.219999999999999 106.444 175.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' PRO . . . . . 0.42 ' HD3' HD13 ' A' ' 28' ' ' LEU . 99.0 Cg_endo -73.95 153.31 47.3 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 121.122 1.215 . . . . 51.810000000000002 112.046 -178.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 31.7 p -112.85 157.06 21.86 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 106.952 -1.499 . . . . 57.439999999999998 106.952 164.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' PHE . . . . . 0.42 ' CZ ' ' HG2' ' A' ' 135' ' ' PRO . 49.0 m-85 -128.78 155.79 44.58 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.533 0.568 . . . . 54.149999999999999 112.533 -170.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -98.52 155.47 17.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.881 -0.599 . . . . 76.480000000000004 110.248 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 35.8 t -91.73 145.94 24.17 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.246 -0.433 . . . . 66.709999999999994 110.503 175.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 14' ' ' ALA . 60.6 mt -86.37 139.37 31.02 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.035 0.445 . . . . 71.0 112.073 178.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -80.41 105.43 11.66 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.947 -0.57 . . . . 80.239999999999995 110.207 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 15.0 pt -76.68 117.76 22.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.173 0.511 . . . . 76.620000000000005 110.064 176.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' THR . . . . . . . . . . . . . 39.9 p -93.53 138.54 31.7 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.981 -0.554 . . . . 78.260000000000005 111.601 -176.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -66.62 152.64 44.94 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.176 -0.465 . . . . 80.239999999999995 111.209 -178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.305 0 CA-C-N 116.059 -0.519 . . . . 85.379999999999995 111.683 178.938 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . 0.699 ' O ' ' HD2' ' A' ' 90' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . 0.511 ' O ' ' CG2' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . 0.484 ' O ' HD12 ' A' ' 122' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_