data_4xjd_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 4xjd _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 tttt . . . . . 0 C--O 1.223 -0.33 0 N-CA-C 111.785 0.291 . . . . 36.78 111.785 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -94.89 114.84 32.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 108.629 -0.878 . . . . 29.01 108.629 170.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -76.0 149.86 37.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.572 -0.74 . . . . 30.27 112.456 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.7 154.65 38.21 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 106.815 -2.514 . . . . 30.19 106.815 167.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -53.64 -53.87 45.71 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.104 0.779 . . . . 37.95 113.104 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.4 m -73.34 -28.57 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.44 -0.904 . . . . 37.94 110.532 -177.288 -66.949 -56.884 -75.971 105.744 2.03 105.089 -48.077 -60.425 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -60.69 -45.3 94.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.956 -0.565 . . . . 33.61 111.257 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.89 -43.98 86.64 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.841 -0.344 . . . . 25.18 111.844 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.79 -45.53 70.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 27.57 112.035 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -37.67 85.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.809 -0.632 . . . . 27.44 110.733 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.97 -42.63 84.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 120.637 -0.425 . . . . 29.9 110.766 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 34.9 mtt -67.21 -41.65 85.44 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.602 0.239 . . . . 27.62 111.127 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.68 -49.4 77.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.809 -0.632 . . . . 43.23 109.473 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.0 ttp-105 -53.21 -36.14 60.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 123.393 0.433 . . . . 39.88 111.396 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . 0.461 ' O ' ' NZ ' ' A' ' 96' ' ' LYS . 89.1 m-70 -87.61 2.09 51.87 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.081 0.771 . . . . 33.03 113.081 -177.862 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.67 52.28 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 115.416 0.927 . . . . 31.52 115.416 171.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.3 tp -82.29 -19.99 38.37 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.926 0.393 . . . . 30.5 111.419 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -65.35 118.76 9.81 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.529 0.68 . . . . 36.63 112.638 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.7 t30 57.96 26.24 13.17 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.268 1.21 . . . . 40.79 114.268 -170.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -67.91 124.34 23.07 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.99 -0.684 . . . . 32.66 109.193 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 56.46 24.94 9.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.736 0.303 . . . . 50.23 111.703 -174.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.32 8.52 83.37 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 114.301 0.481 . . . . 27.41 114.301 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -94.88 109.03 21.07 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 119.775 -0.77 . . . . 26.37 109.981 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 0.53 ' OG ' 'CL ' ' A' ' 202' ' ' ' CL' . 21.3 p -60.19 154.17 20.34 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.694 -0.402 . . . . 31.24 110.3 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 tp -48.6 -36.3 15.43 Favored 'General case' 0 C--O 1.245 0.864 0 N-CA-C 114.279 1.214 . . . . 27.31 114.279 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.87 -32.8 80.91 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 116.042 -0.526 . . . . 24.31 112.975 -176.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -57.22 -40.85 78.35 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.997 0.74 . . . . 24.46 112.997 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.63 -36.79 60.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.435 0.636 . . . . 26.86 110.709 -175.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -67.82 -49.26 70.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.393 -0.821 . . . . 25.55 110.7 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.0 t -52.94 -48.34 67.39 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-O 121.19 0.519 . . . . 26.33 111.542 175.331 -176.256 -94.54 -94.797 102.343 2.047 104.957 -75.086 -59.429 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.11 -48.64 80.88 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.623 -0.717 . . . . 20.88 111.041 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.01 84.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 20.37 110.316 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -60.48 -45.59 93.19 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 112.686 0.625 . . . . 39.42 112.686 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -88.88 -12.71 41.03 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 118.327 -1.349 . . . . 27.11 113.162 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -84.58 -44.98 13.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 23.34 111.508 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.3 p -131.85 -6.47 3.57 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.75 1.389 . . . . 21.85 114.75 -170.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 59.0 t30 57.67 33.02 22.72 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 123.595 0.559 . . . . 36.01 111.97 -169.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 71.8 20.49 4.53 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.838 1.255 . . . . 30.23 113.245 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -100.52 110.44 22.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.574 0.749 . . . . 23.38 112.027 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.1 p -63.72 -18.84 64.43 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 119.688 -0.805 . . . . 24.0 112.873 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -89.91 1.08 56.65 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.374 1.249 . . . . 29.83 114.374 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.36 131.78 52.01 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.08 0.77 . . . . 21.19 113.08 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 81.2 p -136.15 144.81 45.23 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 109.021 -0.733 . . . . 24.16 109.021 170.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -146.9 122.44 10.42 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.149 -0.478 . . . . 32.69 111.096 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 11.9 tpp85 -73.04 139.32 46.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.697 -0.229 . . . . 49.16 111.23 177.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -94.75 170.41 9.47 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.242 -0.583 . . . . 34.09 111.002 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 p -59.3 -29.52 67.67 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.08 0.77 . . . . 45.54 113.08 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 61' ' ' ARG . 2.1 p30 -89.64 4.5 49.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.386 0.884 . . . . 46.53 113.386 -173.208 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.01 -14.69 63.61 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 119.99 -1.1 . . . . 34.4 113.206 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.4 p -75.21 165.3 25.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.644 -0.822 . . . . 32.66 108.972 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.4 m -131.21 144.74 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.222 -0.659 . . . . 24.4 109.222 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -98.66 140.02 33.49 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.364 0.666 . . . . 33.04 109.625 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 93.6 m-85 -131.48 135.48 47.14 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 113.097 0.777 . . . . 25.02 113.097 -173.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.16 -171.3 42.22 Favored Glycine 0 C--O 1.226 -0.393 0 N-CA-C 114.69 0.636 . . . . 22.01 114.69 164.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 tt -64.33 -23.69 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 CA-C-N 115.522 -0.339 . . . . 25.74 111.309 -168.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.1 mt -114.4 15.13 17.99 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.748 1.018 . . . . 27.33 113.748 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 47.53 53.22 11.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.789 -0.642 . . . . 23.6 112.278 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.6 134.79 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.013 -0.994 . . . . 27.46 110.62 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . 0.618 ' OD1' ' N ' ' A' ' 61' ' ' ARG . 32.7 t-20 -87.71 136.27 33.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 124.526 1.13 . . . . 43.44 112.099 -165.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -79.39 -11.68 59.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.614 1.339 . . . . 36.25 114.614 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . 0.618 ' N ' ' OD1' ' A' ' 59' ' ' ASN . 25.0 tpp180 -66.01 -35.51 80.76 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 118.291 0.496 . . . . 49.41 110.643 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -118.68 -33.22 4.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 115.448 1.648 . . . . 50.22 115.448 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -109.58 -24.06 11.15 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 118.546 2.795 . . . . 33.62 118.546 -159.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.76 166.04 26.35 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.761 -0.587 . . . . 29.38 109.555 -178.493 57.319 90.915 93.409 102.556 2.061 108.38 -63.935 -61.915 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -106.4 126.0 51.7 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 113.29 0.848 . . . . 38.77 113.29 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.4 p30 -116.93 11.68 14.44 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.779 0.659 . . . . 29.19 112.779 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.65 -0.76 48.56 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 115.634 1.014 . . . . 32.34 115.634 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 24.0 ptt180 -143.0 14.97 1.9 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.425 1.269 . . . . 37.94 114.425 -171.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.4 m -107.82 99.63 31.09 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 119.601 -0.84 . . . . 41.04 109.175 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -71.9 130.81 17.29 Favored 'Trans proline' 0 CA--C 1.518 -0.323 0 C-N-CA 122.453 2.102 . . . . 48.58 111.702 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.75 40.91 93.94 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.076 -0.81 . . . . 49.39 111.076 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 98.1 p -111.83 168.15 9.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.156 -0.522 . . . . 46.15 110.008 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -112.39 170.66 8.02 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.473 -0.491 . . . . 44.56 109.725 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -133.94 66.94 1.53 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 36.78 108.898 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.69 -22.51 62.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.716 1.006 . . . . 40.33 113.716 -171.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 74.2 m -95.29 4.59 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.273 -0.971 . . . . 36.71 111.98 177.735 -71.25 170.742 83.635 105.06 2.037 110.856 53.937 -169.253 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 49.64 53.91 11.93 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.506 0.558 . . . . 44.97 112.506 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 9.4 pt -144.33 151.31 50.93 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.535 -0.302 . . . . 35.63 110.616 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.62 140.25 29.34 Favored 'Trans proline' 0 C--O 1.234 0.303 0 N-CA-C 108.239 -1.485 . . . . 30.34 108.239 167.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 72.8 m -62.04 -29.07 70.04 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.054 -0.658 . . . . 26.46 111.226 -173.227 -61.915 -63.935 93.409 108.38 2.061 102.556 90.915 57.319 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 p -66.72 -23.42 66.1 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.434 -0.906 . . . . 30.87 111.598 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -23.35 55.99 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.167 0.432 . . . . 35.06 112.167 173.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.0 mt -80.18 -4.12 51.77 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.489 0.551 . . . . 32.7 112.489 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -101.64 5.87 41.74 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.449 0.642 . . . . 31.02 110.535 -173.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 45.5 t -67.78 151.82 46.59 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.872 -1.058 . . . . 41.99 111.724 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.1 p -62.12 -20.35 63.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.848 -1.069 . . . . 36.29 111.476 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.29 146.76 25.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.276 -1.009 . . . . 40.43 108.276 174.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.1 pt -111.46 10.64 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 117.826 -1.55 . . . . 29.03 113.419 -175.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 34.6 m -55.58 -46.08 77.27 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.3 0.852 . . . . 29.74 113.3 -175.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.24 97.05 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.323 -0.551 . . . . 26.99 111.139 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.0 m -61.39 -49.92 74.96 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.507 0.67 . . . . 26.77 112.801 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 59.0 t -63.2 -43.47 98.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.374 -0.83 . . . . 29.81 111.351 -178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -65.84 -41.71 91.4 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 119.746 -0.782 . . . . 45.09 112.167 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.1 t -64.42 -41.07 96.8 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.77 -0.772 . . . . 31.17 110.046 176.554 -169.253 53.937 83.635 110.856 2.037 105.06 170.742 -71.25 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.59 69.0 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.512 0.56 . . . . 25.19 112.512 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . 0.461 ' NZ ' ' O ' ' A' ' 15' ' ' HIS . 95.6 mttt -69.14 -35.52 76.44 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.211 -0.595 . . . . 30.16 109.464 179.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -72.14 -39.92 68.42 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.254 -0.578 . . . . 45.35 111.954 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.3 mt -61.3 -53.17 52.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.024 0.379 . . . . 26.41 112.024 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.59 -10.46 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.79 0.328 . . . . 30.59 110.968 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.9 m -97.05 1.4 50.07 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 112.239 0.459 . . . . 40.89 112.239 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.8 -5.43 37.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.144 0.794 . . . . 39.12 113.144 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.09 -29.6 6.43 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 115.2 0.84 . . . . 38.69 115.2 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -94.45 -3.1 50.68 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.516 1.302 . . . . 42.39 114.516 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.72 -143.63 48.18 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 110.92 -0.872 . . . . 23.74 110.92 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.6 mtp -77.14 -3.24 38.43 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.832 0.679 . . . . 24.6 112.832 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -64.78 -14.2 58.12 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 120.017 -0.673 . . . . 24.04 111.12 173.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.66 -33.48 66.41 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.229 -0.441 . . . . 25.66 110.822 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -92.08 101.89 14.43 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.253 0.549 . . . . 25.15 110.009 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 50.3 t -55.39 -35.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 111.982 0.364 . . . . 32.33 111.982 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.25 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.728 -0.789 . . . . 23.63 111.961 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.48 -47.11 77.18 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.616 -0.833 . . . . 22.95 109.099 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -60.34 -42.48 95.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.096 -0.642 . . . . 35.16 111.346 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -85.35 -21.26 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.69 0.996 . . . . 28.47 113.69 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -123.09 -20.44 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.345 1.609 . . . . 25.63 115.345 -172.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . 0.419 ' O ' ' OG1' ' A' ' 118' ' ' THR . 85.3 m -111.66 -41.07 4.15 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.616 0.599 . . . . 25.28 112.616 -175.949 -59.429 -75.086 -94.797 104.957 2.047 102.343 -94.54 -176.256 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -58.81 130.66 48.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.477 -0.783 . . . . 24.42 110.207 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.2 9.9 86.59 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 116.352 -0.386 . . . . 28.33 112.318 176.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . 0.419 ' OG1' ' O ' ' A' ' 115' ' ' CYS . 49.8 p -106.13 176.44 5.17 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.068 -0.653 . . . . 30.06 109.289 176.603 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . 0.512 ' OD2' ' NE2' ' A' ' 121' ' ' GLN . 26.4 t70 -81.45 79.67 8.01 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.872 -0.788 . . . . 50.6 108.872 176.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.23 -20.82 16.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.46 0 C-N-CA 119.947 -0.701 . . . . 30.61 112.461 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . 0.512 ' NE2' ' OD2' ' A' ' 119' ' ' ASP . 3.8 pm0 -65.31 -17.68 64.7 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.385 -1.326 . . . . 52.44 111.623 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -60.84 -21.56 63.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.291 0.567 . . . . 37.54 111.135 177.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -77.41 -8.05 57.1 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.449 0.907 . . . . 31.08 113.449 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 35.8 pt -119.71 11.18 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 120.07 -0.652 . . . . 36.67 110.09 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -63.72 134.25 55.01 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.072 0.768 . . . . 57.01 113.072 177.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.02 0.85 86.72 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.147 -0.933 . . . . 39.48 112.234 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 80.1 m -88.07 137.82 32.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.902 0.382 . . . . 39.45 111.404 177.895 -60.425 -48.077 -75.971 105.089 2.03 105.744 -56.884 -66.949 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . 0.423 ' N ' ' O ' ' A' ' 301' ' ' HOH . 30.7 ttt85 -87.89 104.78 16.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.76 -0.655 . . . . 40.39 110.041 177.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--N 1.33 -0.269 0 N-CA-C 112.2 0.444 . . . . 47.47 112.2 -169.132 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CL' . . . . . 0.53 'CL ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' CL' . . . . . 0.949 'CL ' ' O ' ' A' ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.423 ' O ' ' N ' ' A' ' 128' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . 0.949 ' O ' 'CL ' ' A' ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 tttt . . . . . 0 C--O 1.223 -0.33 0 N-CA-C 111.785 0.291 . . . . 36.78 111.785 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -94.89 114.84 32.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 108.629 -0.878 . . . . 29.01 108.629 170.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -76.0 149.86 37.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.572 -0.74 . . . . 30.27 112.456 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.7 154.65 38.21 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 106.815 -2.514 . . . . 30.19 106.815 167.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -53.64 -53.87 45.71 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.104 0.779 . . . . 37.95 113.104 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.4 m -73.34 -28.57 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.44 -0.904 . . . . 37.94 110.532 -177.288 -66.949 -56.884 -75.971 105.744 2.03 105.089 -48.077 -60.425 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -60.69 -45.3 94.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.956 -0.565 . . . . 33.61 111.257 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.89 -43.98 86.64 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.841 -0.344 . . . . 25.18 111.844 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.79 -45.53 70.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 27.57 112.035 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -37.67 85.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.809 -0.632 . . . . 27.44 110.733 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.97 -42.63 84.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 120.637 -0.425 . . . . 29.9 110.766 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 34.9 mtt -67.21 -41.65 85.44 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.602 0.239 . . . . 27.62 111.127 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.68 -49.4 77.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.809 -0.632 . . . . 43.23 109.473 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.0 ttp-105 -53.21 -36.14 60.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 123.393 0.433 . . . . 39.88 111.396 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -87.61 2.09 51.87 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.081 0.771 . . . . 33.03 113.081 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.67 52.28 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 115.416 0.927 . . . . 31.52 115.416 171.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 HG13 ' A' ' 92' ' ' VAL . 3.3 tp -82.29 -19.99 38.37 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.926 0.393 . . . . 30.5 111.419 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -65.35 118.76 9.81 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.529 0.68 . . . . 36.63 112.638 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.7 t30 57.96 26.24 13.17 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.268 1.21 . . . . 40.79 114.268 -170.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -67.91 124.34 23.07 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.99 -0.684 . . . . 32.66 109.193 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 56.46 24.94 9.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.736 0.303 . . . . 50.23 111.703 -174.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.32 8.52 83.37 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 114.301 0.481 . . . . 27.41 114.301 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -94.88 109.03 21.07 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 119.775 -0.77 . . . . 26.37 109.981 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.465 ' OG ' 'CL ' ' A' ' 202' ' ' ' CL' . 21.3 p -60.19 154.17 20.34 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.694 -0.402 . . . . 31.24 110.3 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 tp -48.6 -36.3 15.43 Favored 'General case' 0 C--O 1.245 0.864 0 N-CA-C 114.279 1.214 . . . . 27.31 114.279 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.87 -32.8 80.91 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 116.042 -0.526 . . . . 24.31 112.975 -176.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -57.22 -40.85 78.35 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.997 0.74 . . . . 24.46 112.997 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.63 -36.79 60.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.435 0.636 . . . . 26.86 110.709 -175.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -67.82 -49.26 70.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.393 -0.821 . . . . 25.55 110.7 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.0 t -52.94 -48.34 67.39 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-O 121.19 0.519 . . . . 26.33 111.542 175.331 -176.256 -94.54 -94.797 102.343 2.047 104.957 -75.086 -59.429 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.11 -48.64 80.88 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.623 -0.717 . . . . 20.88 111.041 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.01 84.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 20.37 110.316 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -60.48 -45.59 93.19 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 112.686 0.625 . . . . 39.42 112.686 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -88.88 -12.71 41.03 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 118.327 -1.349 . . . . 27.11 113.162 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -84.58 -44.98 13.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 23.34 111.508 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.3 p -131.85 -6.47 3.57 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.75 1.389 . . . . 21.85 114.75 -170.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 59.0 t30 57.67 33.02 22.72 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 123.595 0.559 . . . . 36.01 111.97 -169.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 71.8 20.49 4.53 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.838 1.255 . . . . 30.23 113.245 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -100.52 110.44 22.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.574 0.749 . . . . 23.38 112.027 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.1 p -63.72 -18.84 64.43 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 119.688 -0.805 . . . . 24.0 112.873 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -89.91 1.08 56.65 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.374 1.249 . . . . 29.83 114.374 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.36 131.78 52.01 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.08 0.77 . . . . 21.19 113.08 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 81.2 p -136.15 144.81 45.23 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 109.021 -0.733 . . . . 24.16 109.021 170.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -146.9 122.44 10.42 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.149 -0.478 . . . . 32.69 111.096 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.447 HH21 ' NH2' ' A' ' 68' ' ' ARG . 11.9 tpp85 -73.04 139.32 46.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.697 -0.229 . . . . 49.16 111.23 177.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -94.75 170.41 9.47 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.242 -0.583 . . . . 34.09 111.002 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 p -59.3 -29.52 67.67 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.08 0.77 . . . . 45.54 113.08 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 61' ' ' ARG . 2.1 p30 -89.64 4.5 49.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.386 0.884 . . . . 46.53 113.386 -173.208 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.01 -14.69 63.61 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 119.99 -1.1 . . . . 34.4 113.206 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.4 p -75.21 165.3 25.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.644 -0.822 . . . . 32.66 108.972 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.4 m -131.21 144.74 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.222 -0.659 . . . . 24.4 109.222 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -98.66 140.02 33.49 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.364 0.666 . . . . 33.04 109.625 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 80' ' ' CYS . 93.6 m-85 -131.48 135.48 47.14 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 113.097 0.777 . . . . 25.02 113.097 -173.02 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.16 -171.3 42.22 Favored Glycine 0 C--O 1.226 -0.393 0 N-CA-C 114.69 0.636 . . . . 22.01 114.69 164.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 tt -64.33 -23.69 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 CA-C-N 115.522 -0.339 . . . . 25.74 111.309 -168.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.1 mt -114.4 15.13 17.99 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.748 1.018 . . . . 27.33 113.748 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 47.53 53.22 11.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.789 -0.642 . . . . 23.6 112.278 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.6 134.79 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.013 -0.994 . . . . 27.46 110.62 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 61' ' ' ARG . 32.7 t-20 -87.71 136.27 33.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 124.526 1.13 . . . . 43.44 112.099 -165.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -79.39 -11.68 59.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.614 1.339 . . . . 36.25 114.614 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 48' ' ' ASP . 25.0 tpp180 -66.01 -35.51 80.76 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 118.291 0.496 . . . . 49.41 110.643 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -118.68 -33.22 4.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 115.448 1.648 . . . . 50.22 115.448 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -109.58 -24.06 11.15 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 118.546 2.795 . . . . 33.62 118.546 -159.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.76 166.04 26.35 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.761 -0.587 . . . . 29.38 109.555 -178.493 57.319 90.915 93.409 102.556 2.061 108.38 -63.935 -61.915 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -106.4 126.0 51.7 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 113.29 0.848 . . . . 38.77 113.29 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.4 p30 -116.93 11.68 14.44 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.779 0.659 . . . . 29.19 112.779 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.65 -0.76 48.56 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 115.634 1.014 . . . . 32.34 115.634 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.447 ' NH2' HH21 ' A' ' 45' ' ' ARG . 24.0 ptt180 -143.0 14.97 1.9 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.425 1.269 . . . . 37.94 114.425 -171.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.4 m -107.82 99.63 31.09 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 119.601 -0.84 . . . . 41.04 109.175 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -71.9 130.81 17.29 Favored 'Trans proline' 0 CA--C 1.518 -0.323 0 C-N-CA 122.453 2.102 . . . . 48.58 111.702 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.75 40.91 93.94 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.076 -0.81 . . . . 49.39 111.076 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 98.1 p -111.83 168.15 9.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.156 -0.522 . . . . 46.15 110.008 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -112.39 170.66 8.02 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.473 -0.491 . . . . 44.56 109.725 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -133.94 66.94 1.53 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 36.78 108.898 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.69 -22.51 62.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.716 1.006 . . . . 40.33 113.716 -171.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 74.2 m -95.29 4.59 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.273 -0.971 . . . . 36.71 111.98 177.735 -71.25 170.742 83.635 105.06 2.037 110.856 53.937 -169.253 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 49.64 53.91 11.93 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.506 0.558 . . . . 44.97 112.506 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 9.4 pt -144.33 151.31 50.93 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.535 -0.302 . . . . 35.63 110.616 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.62 140.25 29.34 Favored 'Trans proline' 0 C--O 1.234 0.303 0 N-CA-C 108.239 -1.485 . . . . 30.34 108.239 167.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.419 ' HB3' ' CD1' ' A' ' 53' ' ' TYR . 72.8 m -62.04 -29.07 70.04 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.054 -0.658 . . . . 26.46 111.226 -173.227 -61.915 -63.935 93.409 108.38 2.061 102.556 90.915 57.319 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 p -66.72 -23.42 66.1 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.434 -0.906 . . . . 30.87 111.598 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -23.35 55.99 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.167 0.432 . . . . 35.06 112.167 173.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.0 mt -80.18 -4.12 51.77 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.489 0.551 . . . . 32.7 112.489 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -101.64 5.87 41.74 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.449 0.642 . . . . 31.02 110.535 -173.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 45.5 t -67.78 151.82 46.59 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.872 -1.058 . . . . 41.99 111.724 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.1 p -62.12 -20.35 63.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.848 -1.069 . . . . 36.29 111.476 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.29 146.76 25.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.276 -1.009 . . . . 40.43 108.276 174.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.1 pt -111.46 10.64 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 117.826 -1.55 . . . . 29.03 113.419 -175.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 34.6 m -55.58 -46.08 77.27 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.3 0.852 . . . . 29.74 113.3 -175.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.24 97.05 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.323 -0.551 . . . . 26.99 111.139 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.0 m -61.39 -49.92 74.96 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.507 0.67 . . . . 26.77 112.801 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 17' ' ' LEU . 59.0 t -63.2 -43.47 98.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.374 -0.83 . . . . 29.81 111.351 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -65.84 -41.71 91.4 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 119.746 -0.782 . . . . 45.09 112.167 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.1 t -64.42 -41.07 96.8 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.77 -0.772 . . . . 31.17 110.046 176.554 -169.253 53.937 83.635 110.856 2.037 105.06 170.742 -71.25 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.59 69.0 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.512 0.56 . . . . 25.19 112.512 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.14 -35.52 76.44 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.211 -0.595 . . . . 30.16 109.464 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -72.14 -39.92 68.42 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.254 -0.578 . . . . 45.35 111.954 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.3 mt -61.3 -53.17 52.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.024 0.379 . . . . 26.41 112.024 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.59 -10.46 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.79 0.328 . . . . 30.59 110.968 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.9 m -97.05 1.4 50.07 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 112.239 0.459 . . . . 40.89 112.239 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.8 -5.43 37.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.144 0.794 . . . . 39.12 113.144 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.09 -29.6 6.43 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 115.2 0.84 . . . . 38.69 115.2 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -94.45 -3.1 50.68 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.516 1.302 . . . . 42.39 114.516 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.72 -143.63 48.18 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 110.92 -0.872 . . . . 23.74 110.92 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.6 mtp -77.14 -3.24 38.43 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.832 0.679 . . . . 24.6 112.832 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -64.78 -14.2 58.12 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 120.017 -0.673 . . . . 24.04 111.12 173.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.66 -33.48 66.41 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.229 -0.441 . . . . 25.66 110.822 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -92.08 101.89 14.43 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.253 0.549 . . . . 25.15 110.009 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 50.3 t -55.39 -35.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 111.982 0.364 . . . . 32.33 111.982 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.25 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.728 -0.789 . . . . 23.63 111.961 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.48 -47.11 77.18 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.616 -0.833 . . . . 22.95 109.099 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -60.34 -42.48 95.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.096 -0.642 . . . . 35.16 111.346 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -85.35 -21.26 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.69 0.996 . . . . 28.47 113.69 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -123.09 -20.44 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.345 1.609 . . . . 25.63 115.345 -172.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 85.3 m -111.66 -41.07 4.15 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.616 0.599 . . . . 25.28 112.616 -175.949 -59.429 -75.086 -94.797 104.957 2.047 102.343 -94.54 -176.256 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -58.81 130.66 48.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.477 -0.783 . . . . 24.42 110.207 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.2 9.9 86.59 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 116.352 -0.386 . . . . 28.33 112.318 176.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 49.8 p -106.13 176.44 5.17 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.068 -0.653 . . . . 30.06 109.289 176.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -81.45 79.67 8.01 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.872 -0.788 . . . . 50.6 108.872 176.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.23 -20.82 16.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.46 0 C-N-CA 119.947 -0.701 . . . . 30.61 112.461 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.31 -17.68 64.7 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.385 -1.326 . . . . 52.44 111.623 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 0.683 ' HA ' ' HG3' ' A' ' 125' ' ' ARG . . . -60.84 -21.56 63.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.291 0.567 . . . . 37.54 111.135 177.235 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -77.41 -8.05 57.1 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.449 0.907 . . . . 31.08 113.449 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 35.8 pt -119.71 11.18 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 120.07 -0.652 . . . . 36.67 110.09 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . 0.683 ' HG3' ' HA ' ' A' ' 122' ' ' ALA . 0.8 OUTLIER -63.72 134.25 55.01 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.072 0.768 . . . . 57.01 113.072 177.286 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.02 0.85 86.72 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.147 -0.933 . . . . 39.48 112.234 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 80.1 m -88.07 137.82 32.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.902 0.382 . . . . 39.45 111.404 177.895 -60.425 -48.077 -75.971 105.089 2.03 105.744 -56.884 -66.949 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.7 ttt85 -87.89 104.78 16.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.76 -0.655 . . . . 40.39 110.041 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--N 1.33 -0.269 0 N-CA-C 112.2 0.444 . . . . 47.47 112.2 -169.132 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CL' . . . . . 0.465 'CL ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' CL' . . . . . 0.949 'CL ' ' O ' ' A' ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . 0.949 ' O ' 'CL ' ' A' ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 79.9 tttt . . . . . 0 C--O 1.223 -0.33 0 N-CA-C 111.785 0.291 . . . . 36.780000000000001 111.785 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 59.3 t -94.89 114.84 32.3 Favored 'Isoleucine or valine' 0 C--O 1.238 0.478 0 N-CA-C 108.629 -0.878 . . . . 29.010000000000002 108.629 170.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -76.0 149.86 37.5 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.572 -0.74 . . . . 30.27 112.456 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.7 154.65 38.21 Favored Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 106.815 -2.514 . . . . 30.190000000000001 106.815 167.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -53.64 -53.87 45.71 Favored 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 113.104 0.779 . . . . 37.950000000000003 113.104 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 88.4 m -73.34 -28.57 62.13 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.44 -0.904 . . . . 37.939999999999998 110.532 -177.288 -66.949 -56.884 -75.971 105.744 2.03 105.089 -48.077 -60.425 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -60.69 -45.3 94.71 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.956 -0.565 . . . . 33.609999999999999 111.257 175.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.6 tp -65.89 -43.98 86.64 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.841 -0.344 . . . . 25.18 111.844 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.79 -45.53 70.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.322 0.582 . . . . 27.57 112.035 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.73 -37.67 85.13 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.809 -0.632 . . . . 27.440000000000001 110.733 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -66.97 -42.63 84.82 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 120.637 -0.425 . . . . 29.899999999999999 110.766 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 34.9 mtt -67.21 -41.65 85.44 Favored 'General case' 0 CA--C 1.521 -0.169 0 CA-C-O 120.602 0.239 . . . . 27.620000000000001 111.127 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.6 tttp -59.68 -49.4 77.9 Favored 'General case' 0 CA--C 1.514 -0.426 0 CA-C-N 115.809 -0.632 . . . . 43.229999999999997 109.473 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.0 ttp-105 -53.21 -36.14 60.68 Favored 'General case' 0 CA--C 1.519 -0.223 0 O-C-N 123.393 0.433 . . . . 39.880000000000003 111.396 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -87.61 2.09 51.87 Favored 'General case' 0 CA--C 1.536 0.436 0 N-CA-C 113.081 0.771 . . . . 33.030000000000001 113.081 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.89 22.67 52.28 Favored Glycine 0 CA--C 1.52 0.365 0 N-CA-C 115.416 0.927 . . . . 31.52 115.416 171.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.414 HD13 HG13 ' A' ' 92' ' ' VAL . 3.3 tp -82.29 -19.99 38.37 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-O 120.926 0.393 . . . . 30.5 111.419 177.783 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 16.0 p-10 -65.35 118.76 9.81 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-O 121.529 0.68 . . . . 36.630000000000003 112.638 179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.7 t30 57.96 26.24 13.17 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 114.268 1.21 . . . . 40.789999999999999 114.268 -170.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -67.91 124.34 23.07 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 119.99 -0.684 . . . . 32.659999999999997 109.193 172.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 56.46 24.94 9.1 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.736 0.303 . . . . 50.229999999999997 111.703 -174.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 84.32 8.52 83.37 Favored Glycine 0 N--CA 1.445 -0.764 0 N-CA-C 114.301 0.481 . . . . 27.41 114.301 175.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -94.88 109.03 21.07 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 119.775 -0.77 . . . . 26.370000000000001 109.981 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.465 ' OG ' 'CL ' ' A' ' 202' ' ' ' CL' . 21.3 p -60.19 154.17 20.34 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 120.694 -0.402 . . . . 31.239999999999998 110.3 179.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 22.7 tp -48.6 -36.3 15.43 Favored 'General case' 0 C--O 1.245 0.864 0 N-CA-C 114.279 1.214 . . . . 27.309999999999999 114.279 -172.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -60.87 -32.8 80.91 Favored Glycine 0 N--CA 1.452 -0.255 0 CA-C-N 116.042 -0.526 . . . . 24.309999999999999 112.975 -176.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 69.0 m-80 -57.22 -40.85 78.35 Favored 'General case' 0 C--N 1.332 -0.166 0 N-CA-C 112.997 0.74 . . . . 24.460000000000001 112.997 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -75.63 -36.79 60.11 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-O 121.435 0.636 . . . . 26.859999999999999 110.709 -175.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.9 t -67.82 -49.26 70.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.393 -0.821 . . . . 25.550000000000001 110.7 175.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 42.0 t -52.94 -48.34 67.39 Favored 'General case' 0 C--O 1.25 1.083 0 CA-C-O 121.19 0.519 . . . . 26.329999999999998 111.542 175.331 -176.256 -94.54 -94.797 102.343 2.047 104.957 -75.086 -59.429 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.11 -48.64 80.88 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 115.623 -0.717 . . . . 20.879999999999999 111.041 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -60.85 -38.01 84.05 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.118 0.485 . . . . 20.370000000000001 110.316 -177.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 54.3 tptt -60.48 -45.59 93.19 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 112.686 0.625 . . . . 39.420000000000002 112.686 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -88.88 -12.71 41.03 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 118.327 -1.349 . . . . 27.109999999999999 113.162 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 58.4 mm-40 -84.58 -44.98 13.01 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.958 0.409 . . . . 23.34 111.508 174.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.3 p -131.85 -6.47 3.57 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 114.75 1.389 . . . . 21.850000000000001 114.75 -170.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 59.0 t30 57.67 33.02 22.72 Favored 'General case' 0 C--O 1.241 0.616 0 O-C-N 123.595 0.559 . . . . 36.009999999999998 111.97 -169.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 71.8 20.49 4.53 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.838 1.255 . . . . 30.23 113.245 177.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -100.52 110.44 22.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.574 0.749 . . . . 23.379999999999999 112.027 -177.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 62.1 p -63.72 -18.84 64.43 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 119.688 -0.805 . . . . 24.0 112.873 -179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -89.91 1.08 56.65 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 114.374 1.249 . . . . 29.829999999999998 114.374 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.36 131.78 52.01 Favored 'General case' 0 C--O 1.22 -0.493 0 N-CA-C 113.08 0.77 . . . . 21.190000000000001 113.08 -176.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 81.2 p -136.15 144.81 45.23 Favored 'General case' 0 C--O 1.242 0.669 0 N-CA-C 109.021 -0.733 . . . . 24.16 109.021 170.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -146.9 122.44 10.42 Favored 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 116.149 -0.478 . . . . 32.689999999999998 111.096 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.447 HH21 ' NH2' ' A' ' 68' ' ' ARG . 11.9 tpp85 -73.04 139.32 46.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.697 -0.229 . . . . 49.159999999999997 111.23 177.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -94.75 170.41 9.47 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.242 -0.583 . . . . 34.090000000000003 111.002 173.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 18.7 p -59.3 -29.52 67.67 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.08 0.77 . . . . 45.539999999999999 113.08 -179.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.419 ' O ' ' NH2' ' A' ' 61' ' ' ARG . 2.1 p30 -89.64 4.5 49.27 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 113.386 0.884 . . . . 46.530000000000001 113.386 -173.208 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 97.01 -14.69 63.61 Favored Glycine 0 N--CA 1.444 -0.779 0 C-N-CA 119.99 -1.1 . . . . 34.399999999999999 113.206 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 88.4 p -75.21 165.3 25.41 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 119.644 -0.822 . . . . 32.659999999999997 108.972 176.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 65.4 m -131.21 144.74 51.56 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.222 -0.659 . . . . 24.399999999999999 109.222 -178.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -98.66 140.02 33.49 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.364 0.666 . . . . 33.039999999999999 109.625 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.419 ' CD1' ' HB3' ' A' ' 80' ' ' CYS . 93.6 m-85 -131.48 135.48 47.14 Favored 'General case' 0 C--O 1.225 -0.193 0 N-CA-C 113.097 0.777 . . . . 25.02 113.097 -173.02 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 87.16 -171.3 42.22 Favored Glycine 0 C--O 1.226 -0.393 0 N-CA-C 114.69 0.636 . . . . 22.010000000000002 114.69 164.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 2.3 tt -64.33 -23.69 33.97 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.071 0 CA-C-N 115.522 -0.339 . . . . 25.739999999999998 111.309 -168.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.1 mt -114.4 15.13 17.99 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 113.748 1.018 . . . . 27.329999999999998 113.748 178.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 42.6 mm-40 47.53 53.22 11.4 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.789 -0.642 . . . . 23.600000000000001 112.278 172.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 64.4 mt -73.6 134.79 28.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 CA-C-N 115.013 -0.994 . . . . 27.460000000000001 110.62 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 61' ' ' ARG . 32.7 t-20 -87.71 136.27 33.02 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 124.526 1.13 . . . . 43.439999999999998 112.099 -165.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 86.8 p -79.39 -11.68 59.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 114.614 1.339 . . . . 36.25 114.614 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.419 ' NH2' ' O ' ' A' ' 48' ' ' ASP . 25.0 tpp180 -66.01 -35.51 80.76 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 118.291 0.496 . . . . 49.409999999999997 110.643 178.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -118.68 -33.22 4.33 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 115.448 1.648 . . . . 50.219999999999999 115.448 -175.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 65.5 m95 -109.58 -24.06 11.15 Favored 'General case' 0 C--O 1.217 -0.653 0 N-CA-C 118.546 2.795 . . . . 33.619999999999997 118.546 -159.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.1 p -144.76 166.04 26.35 Favored 'General case' 0 C--N 1.328 -0.348 0 O-C-N 121.761 -0.587 . . . . 29.379999999999999 109.555 -178.493 57.319 90.915 93.409 102.556 2.061 108.38 -63.935 -61.915 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 22.2 t30 -106.4 126.0 51.7 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 113.29 0.848 . . . . 38.770000000000003 113.29 175.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 58.4 p30 -116.93 11.68 14.44 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.779 0.659 . . . . 29.190000000000001 112.779 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 73.65 -0.76 48.56 Favored Glycine 0 C--O 1.237 0.31 0 N-CA-C 115.634 1.014 . . . . 32.340000000000003 115.634 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.447 ' NH2' HH21 ' A' ' 45' ' ' ARG . 24.0 ptt180 -143.0 14.97 1.9 Allowed 'General case' 0 N--CA 1.449 -0.514 0 N-CA-C 114.425 1.269 . . . . 37.939999999999998 114.425 -171.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.4 m -107.82 99.63 31.09 Favored Pre-proline 0 C--N 1.324 -0.516 0 C-N-CA 119.601 -0.84 . . . . 41.039999999999999 109.175 175.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -71.9 130.81 17.29 Favored 'Trans proline' 0 CA--C 1.518 -0.323 0 C-N-CA 122.453 2.102 . . . . 48.579999999999998 111.702 -170.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.75 40.91 93.94 Favored Glycine 0 N--CA 1.45 -0.418 0 N-CA-C 111.076 -0.81 . . . . 49.390000000000001 111.076 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 98.1 p -111.83 168.15 9.8 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.156 -0.522 . . . . 46.149999999999999 110.008 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 38.8 mmm-85 -112.39 170.66 8.02 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 120.473 -0.491 . . . . 44.560000000000002 109.725 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -133.94 66.94 1.53 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.343 -0.844 . . . . 36.780000000000001 108.898 178.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -70.69 -22.51 62.45 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.716 1.006 . . . . 40.329999999999998 113.716 -171.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 74.2 m -95.29 4.59 53.31 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 119.273 -0.971 . . . . 36.710000000000001 111.98 177.735 -71.25 170.742 83.635 105.06 2.037 110.856 53.937 -169.253 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 49.64 53.91 11.93 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.506 0.558 . . . . 44.969999999999999 112.506 175.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 9.4 pt -144.33 151.31 50.93 Favored Pre-proline 0 N--CA 1.464 0.246 0 CA-C-N 116.535 -0.302 . . . . 35.630000000000003 110.616 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -73.62 140.25 29.34 Favored 'Trans proline' 0 C--O 1.234 0.303 0 N-CA-C 108.239 -1.485 . . . . 30.34 108.239 167.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.419 ' HB3' ' CD1' ' A' ' 53' ' ' TYR . 72.8 m -62.04 -29.07 70.04 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.054 -0.658 . . . . 26.460000000000001 111.226 -173.227 -61.915 -63.935 93.409 108.38 2.061 102.556 90.915 57.319 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 22.1 p -66.72 -23.42 66.1 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 119.434 -0.906 . . . . 30.870000000000001 111.598 -177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.28 -23.35 55.99 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 112.167 0.432 . . . . 35.060000000000002 112.167 173.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.0 mt -80.18 -4.12 51.77 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 112.489 0.551 . . . . 32.700000000000003 112.489 -178.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 77.1 mt -101.64 5.87 41.74 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 121.449 0.642 . . . . 31.02 110.535 -173.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 45.5 t -67.78 151.82 46.59 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 114.872 -1.058 . . . . 41.990000000000002 111.724 176.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 79.1 p -62.12 -20.35 63.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 114.848 -1.069 . . . . 36.289999999999999 111.476 175.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -88.29 146.76 25.14 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 108.276 -1.009 . . . . 40.43 108.276 174.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 39.1 pt -111.46 10.64 8.53 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 C-N-CA 117.826 -1.55 . . . . 29.030000000000001 113.419 -175.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 34.6 m -55.58 -46.08 77.27 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 113.3 0.852 . . . . 29.739999999999998 113.3 -175.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -64.25 -41.24 97.05 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.323 -0.551 . . . . 26.989999999999998 111.139 -179.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 16.0 m -61.39 -49.92 74.96 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.507 0.67 . . . . 26.77 112.801 177.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.414 HG13 HD13 ' A' ' 17' ' ' LEU . 59.0 t -63.2 -43.47 98.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.374 -0.83 . . . . 29.809999999999999 111.351 -178.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -65.84 -41.71 91.4 Favored 'General case' 0 C--O 1.242 0.695 0 C-N-CA 119.746 -0.782 . . . . 45.090000000000003 112.167 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.1 t -64.42 -41.07 96.8 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 119.77 -0.772 . . . . 31.170000000000002 110.046 176.554 -169.253 53.937 83.635 110.856 2.037 105.06 170.742 -71.25 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.78 -30.59 69.0 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 112.512 0.56 . . . . 25.190000000000001 112.512 178.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -69.14 -35.52 76.44 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.211 -0.595 . . . . 30.16 109.464 179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 11.7 tttm -72.14 -39.92 68.42 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.254 -0.578 . . . . 45.350000000000001 111.954 176.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 46.3 mt -61.3 -53.17 52.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 N-CA-C 112.024 0.379 . . . . 26.41 112.024 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 8.4 p -66.59 -10.46 11.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 CA-C-O 120.79 0.328 . . . . 30.59 110.968 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 16.9 m -97.05 1.4 50.07 Favored 'General case' 0 C--O 1.234 0.284 0 N-CA-C 112.239 0.459 . . . . 40.890000000000001 112.239 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -72.8 -5.43 37.94 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 113.144 0.794 . . . . 39.119999999999997 113.144 -173.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 118.09 -29.6 6.43 Favored Glycine 0 CA--C 1.524 0.629 0 N-CA-C 115.2 0.84 . . . . 38.689999999999998 115.2 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -94.45 -3.1 50.68 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 114.516 1.302 . . . . 42.390000000000001 114.516 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 60.72 -143.63 48.18 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 110.92 -0.872 . . . . 23.739999999999998 110.92 -177.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 45.6 mtp -77.14 -3.24 38.43 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.832 0.679 . . . . 24.600000000000001 112.832 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 69.7 m-80 -64.78 -14.2 58.12 Favored 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 120.017 -0.673 . . . . 24.039999999999999 111.12 173.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -56.66 -33.48 66.41 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.229 -0.441 . . . . 25.66 110.822 172.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 31.1 m-90 -92.08 101.89 14.43 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-O 121.253 0.549 . . . . 25.149999999999999 110.009 173.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 50.3 t -55.39 -35.4 37.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 111.982 0.364 . . . . 32.329999999999998 111.982 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.01 -32.25 72.5 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.728 -0.789 . . . . 23.629999999999999 111.961 179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.48 -47.11 77.18 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 119.616 -0.833 . . . . 22.949999999999999 109.099 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 18.8 ttt180 -60.34 -42.48 95.77 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 120.096 -0.642 . . . . 35.159999999999997 111.346 -178.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 95.9 m-20 -85.35 -21.26 28.98 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 113.69 0.996 . . . . 28.469999999999999 113.69 -173.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 59.7 mtp180 -123.09 -20.44 5.74 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 115.345 1.609 . . . . 25.629999999999999 115.345 -172.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 85.3 m -111.66 -41.07 4.15 Favored 'General case' 0 C--O 1.238 0.481 0 N-CA-C 112.616 0.599 . . . . 25.280000000000001 112.616 -175.949 -59.429 -75.086 -94.797 104.957 2.047 102.343 -94.54 -176.256 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -58.81 130.66 48.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.477 -0.783 . . . . 24.420000000000002 110.207 -174.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 79.2 9.9 86.59 Favored Glycine 0 N--CA 1.452 -0.274 0 CA-C-N 116.352 -0.386 . . . . 28.329999999999998 112.318 176.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 49.8 p -106.13 176.44 5.17 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 120.068 -0.653 . . . . 30.059999999999999 109.289 176.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.512 ' OD2' ' NE2' ' A' ' 121' ' ' GLN . 26.4 t70 -81.45 79.67 8.01 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.872 -0.788 . . . . 50.600000000000001 108.872 176.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.9 m -75.23 -20.82 16.3 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.46 0 C-N-CA 119.947 -0.701 . . . . 30.609999999999999 112.461 -169.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.577 HE21 HH22 ' A' ' 125' ' ' ARG . 3.8 pm0 -65.31 -17.68 64.7 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 118.385 -1.326 . . . . 52.439999999999998 111.623 178.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.683 ' HA ' ' HG3' ' A' ' 125' ' ' ARG . . . -60.84 -21.56 63.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.291 0.567 . . . . 37.539999999999999 111.135 177.235 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -77.41 -8.05 57.1 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.449 0.907 . . . . 31.079999999999998 113.449 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 35.8 pt -119.71 11.18 6.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 120.07 -0.652 . . . . 36.670000000000002 110.09 176.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.683 ' HG3' ' HA ' ' A' ' 122' ' ' ALA . 0.8 OUTLIER -63.72 134.25 55.01 Favored 'General case' 0 CA--C 1.514 -0.414 0 N-CA-C 113.072 0.768 . . . . 57.009999999999998 113.072 177.286 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.02 0.85 86.72 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-N 115.147 -0.933 . . . . 39.479999999999997 112.234 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 80.1 m -88.07 137.82 32.0 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.902 0.382 . . . . 39.450000000000003 111.404 177.895 -60.425 -48.077 -75.971 105.089 2.03 105.744 -56.884 -66.949 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 30.7 ttt85 -87.89 104.78 16.92 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.76 -0.655 . . . . 40.390000000000001 110.041 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 7.8 mt . . . . . 0 C--N 1.33 -0.269 0 N-CA-C 112.2 0.444 . . . . 47.469999999999999 112.2 -169.132 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CL' . . . . . 0.465 'CL ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' CL' . . . . . 0.949 'CL ' ' O ' ' A' ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . 0.949 ' O ' 'CL ' ' A' ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_