data_4xic_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 4xic _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 ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.558 -0.164 . . . . 125.05 110.558 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -108.77 -52.49 2.76 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.018 0.747 . . . . 130.47 113.018 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.17 149.95 11.73 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.504 -0.855 . . . . 102.93 111.957 177.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 0.694 ' NH1' ' O2 ' ' C' ' 27' ' ' ' DT' . 20.1 ttt180 -159.34 131.89 6.73 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.339 -0.615 . . . . 69.41 109.339 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -108.01 129.81 55.1 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.769 -0.826 . . . . 70.08 108.769 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.1 p -96.33 132.3 41.97 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.738 -0.838 . . . . 64.5 108.738 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -82.65 135.38 35.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.099 0.476 . . . . 57.44 110.345 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -63.81 171.26 2.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.798 0.809 . . . . 55.8 110.19 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -64.56 -37.38 87.35 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.114 -1.034 . . . . 107.52 110.602 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -65.44 -49.14 70.29 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.911 0.386 . . . . 72.09 110.777 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -58.84 -52.72 64.53 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.71 0.291 . . . . 57.17 111.107 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.9 m -58.93 -32.24 69.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.359 -0.536 . . . . 44.21 111.418 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -71.89 -54.67 9.34 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.774 0.321 . . . . 66.05 110.794 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -55.04 -43.04 73.38 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.653 -0.419 . . . . 60.36 110.968 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.76 -47.47 85.06 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 120.743 0.306 . . . . 38.77 111.398 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -63.41 -32.68 74.18 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.483 -0.887 . . . . 69.66 111.23 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -62.29 -53.23 58.11 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 121.024 -0.27 . . . . 46.67 110.953 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.9 tp10 -57.91 -37.51 74.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.96 -0.696 . . . . 66.45 111.435 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 63.5 t80 -67.28 -20.98 65.71 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.497 0.554 . . . . 55.46 112.497 -178.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -65.1 -26.06 68.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.363 -0.535 . . . . 66.75 111.531 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -100.47 -51.21 3.68 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 112.828 0.677 . . . . 60.95 112.828 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -118.51 105.05 11.26 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.208 -1.034 . . . . 57.75 108.208 -176.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 83.5 mtm-85 -67.02 -22.43 65.89 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 118.814 -1.154 . . . . 51.53 112.191 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . 0.555 ' OH ' ' OP1' ' B' ' 6' ' ' ' DC' . 84.3 m-85 -126.53 152.09 47.0 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.813 0.845 . . . . 44.16 109.188 171.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.7 tp -123.41 138.04 54.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.252 -0.431 . . . . 55.22 111.713 -171.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.6 p -80.55 163.06 23.99 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.459 0.647 . . . . 43.98 109.748 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.1 ttt-85 -62.26 -37.77 86.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.193 -1.003 . . . . 81.47 110.998 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -66.05 -39.95 90.54 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.286 -0.966 . . . . 56.69 110.942 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' NH1' ' OE1' ' A' ' 33' ' ' GLU . 24.0 tpt85 -65.61 -35.87 82.08 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.689 -0.804 . . . . 76.96 111.158 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . 0.456 ' NH1' ' O ' ' A' ' 101' ' ' HOH . 45.2 mtm-85 -65.35 -43.69 90.07 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 120.062 -0.655 . . . . 62.66 111.74 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.91 -42.59 89.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 119.56 -0.856 . . . . 48.3 110.665 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . 0.464 ' OE1' ' NH1' ' A' ' 30' ' ' ARG . 91.5 mt-10 -55.37 -57.45 11.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.893 -0.505 . . . . 66.42 111.078 177.004 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 59.6 mt -58.82 -42.28 85.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 120.926 0.393 . . . . 42.06 110.508 -177.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.9 -55.04 26.19 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.104 -0.372 . . . . 50.34 110.992 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -62.23 -39.22 92.09 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 72.98 111.029 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.44 78.23 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 122.291 -0.256 . . . . 55.71 111.663 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.7 mt -109.47 4.17 22.07 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.422 0.897 . . . . 51.14 113.422 -173.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.6 m 56.68 52.82 9.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.094 0.95 . . . . 52.73 110.976 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.3 mt -127.33 165.11 20.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.836 0.827 . . . . 63.46 109.138 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 25.5 m -82.46 146.55 29.21 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.091 -0.959 . . . . 55.03 110.597 177.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -51.88 -42.81 62.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.614 -0.721 . . . . 80.57 111.162 171.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 53.6 ttt85 -60.81 -41.43 95.67 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.838 -0.345 . . . . 88.36 111.402 176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -66.41 -37.91 86.29 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.315 -0.554 . . . . 53.13 111.13 -179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.92 -42.06 93.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 120.655 -0.418 . . . . 39.86 110.516 175.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.1 -50.36 73.03 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.561 -0.456 . . . . 73.16 110.75 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.9 mt -64.58 -42.29 94.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 120.798 0.332 . . . . 54.78 111.107 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -56.37 -52.8 63.27 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.084 -0.646 . . . . 41.1 110.989 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -58.6 -33.94 70.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.589 -0.844 . . . . 34.26 111.384 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.66 -54.27 41.99 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.504 -0.879 . . . . 50.89 111.187 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.58 -48.27 82.53 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.18 -0.608 . . . . 49.84 111.015 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 -59.36 -32.11 69.81 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.916 -0.714 . . . . 51.75 111.413 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -66.52 -35.34 80.01 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.818 -0.753 . . . . 50.15 111.288 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 59.2 mmm -66.89 -44.35 81.08 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 121.169 -0.212 . . . . 104.96 110.951 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . . . -60.53 -36.33 78.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.192 -0.603 . . . . 77.23 111.291 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -67.95 -26.29 65.87 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.542 0.571 . . . . 96.31 112.542 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -77.01 -41.92 40.77 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.262 -0.575 . . . . 110.84 111.96 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -67.64 -38.83 84.41 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.501 -0.48 . . . . 103.09 111.239 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -70.8 -27.58 64.0 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.709 -0.397 . . . . 109.99 111.768 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 121.25 0.548 . . . . 110.11 112.054 176.248 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 0' ' ' ' DA' . . . . . 0.462 ' N3 ' " O5'" ' B' ' 0' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.246 0 O4'-C1'-N19 108.558 0.947 . . . . 54.3 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.402 -2.356 0 C3'-C2'-C1' 99.71 -2.136 . . . . 70.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O5'--C5' 1.364 -4.765 0 O4'-C1'-N19 106.315 -1.856 . . . . 54.54 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.097 0 C3'-C2'-C1' 100.029 -1.908 . . . . 64.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.317 0 OP1-P-OP2 121.682 1.388 . . . . 71.19 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.36 0 P-O3'-C3' 121.811 1.759 . . . . 50.09 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.555 ' OP1' ' OH ' ' A' ' 25' ' ' TYR . . . . . . . . 0 O3'--C3' 1.4 -2.364 0 OP1-P-OP2 121.67 1.38 . . . . 69.4 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' C2S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.804 0 P-O3'-C3' 123.616 3.264 . . . . 101.98 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.543 2.479 0 O4'-C1'-N19 109.685 2.356 . . . . 104.56 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.6 0 C3'-C2'-C1' 100.749 -1.393 . . . . 95.9 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.266 0 C3'-C2'-C1' 99.197 -2.502 . . . . 88.76 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.396 -2.696 0 C3'-C2'-C1' 98.756 -2.817 . . . . 101.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.74 0 C3'-C2'-C1' 99.195 -2.504 . . . . 91.13 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 P-O3'-C3' 121.4 1.417 . . . . 100.63 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.477 3.535 0 O4'-C1'-C2' 108.23 1.936 . . . . 90.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.056 1 P-O3'-C3' 124.911 4.343 . . . . 96.19 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.21 0 P-O5'-C5' 117.643 -2.036 . . . . 95.72 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.415 -1.238 0 P-O3'-C3' 121.161 1.217 . . . . 102.26 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' ' DT' . . . . . 0.694 ' O2 ' ' NH1' ' A' ' 5' ' ' ARG . . . . . . . . 0 O3'--C3' 1.394 -2.864 0 O4'-C1'-N19 110.54 3.425 . . . . 72.26 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.201 0 C3'-C2'-C1' 100.484 -1.583 . . . . 51.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.548 2.99 0 C1'-O4'-C4' 107.007 -1.923 . . . . 51.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.157 0 C4'-C3'-C2' 104.911 1.711 . . . . 81.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.291 0 C3'-C2'-C1' 101.214 -1.061 . . . . 102.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.528 1.006 0 O4'-C1'-N19 109.044 1.555 . . . . 98.1 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.359 0 C4'-C3'-C2' 105.216 2.016 . . . . 93.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.526 0 C3'-C2'-C1' 100.997 -1.217 . . . . 90.4 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.581 0 C3'-C2'-C1' 100.745 -1.396 . . . . 90.43 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.399 -2.433 0 O4'-C1'-C2' 103.841 -2.054 . . . . 61.56 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.156 0 OP1-P-OP2 122.179 1.719 . . . . 62.97 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ARG . . . . . 0.499 ' NH1' ' O2 ' ' F' ' 27' ' ' ' DT' . 19.9 ttt180 . . . . . 0 C--O 1.238 0.449 0 N-CA-C 113.274 0.842 . . . . 79.47 113.274 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -108.38 129.26 55.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.639 0.776 . . . . 99.58 109.468 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 37.6 p -97.87 131.81 44.02 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.21 0.604 . . . . 81.89 110.039 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -83.75 136.53 34.13 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.352 0.596 . . . . 66.03 112.128 -170.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' THR . . . . . . . . . . . . . 11.2 p -63.22 168.76 4.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.979 0.895 . . . . 58.66 110.54 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.4 -38.9 81.76 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.359 -0.837 . . . . 63.59 110.802 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.7 -49.17 71.94 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.365 -0.534 . . . . 60.18 111.03 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -59.32 -53.01 63.14 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.564 -0.455 . . . . 69.05 111.496 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -60.0 -33.1 71.52 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.121 -0.631 . . . . 41.05 111.729 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 35.9 tp -73.57 -53.76 9.76 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.137 -0.625 . . . . 47.55 110.851 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -52.64 -43.51 65.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.737 -0.385 . . . . 68.66 111.565 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.4 -44.07 97.3 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 121.023 -0.271 . . . . 45.55 111.383 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' GLU . . . . . 0.405 ' OE2' ' NE ' ' D' ' 52' ' ' ARG . 19.7 tp10 -63.26 -35.45 80.4 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.245 -0.582 . . . . 72.29 111.206 179.087 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -64.18 -48.1 77.26 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.786 0.327 . . . . 48.12 110.76 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -54.05 -39.72 66.49 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.718 0.294 . . . . 71.61 111.076 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -69.51 -22.32 63.6 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.521 0.563 . . . . 61.18 112.521 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -65.79 -25.2 67.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.352 -0.539 . . . . 58.09 111.301 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -100.06 -52.38 3.43 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.65 0.611 . . . . 75.85 112.65 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -120.34 103.57 9.32 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.006 -0.738 . . . . 83.77 109.006 -174.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -61.92 -19.77 63.07 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.837 -0.745 . . . . 71.39 111.797 172.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -125.09 153.78 42.42 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.576 -0.898 . . . . 69.48 108.576 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 tp -119.99 135.21 55.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.74 -0.664 . . . . 75.98 110.511 -171.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 56.8 p -81.07 162.56 23.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.835 0.826 . . . . 77.16 110.442 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' ARG . . . . . . . . . . . . . 14.4 tpt85 -63.3 -38.59 91.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.282 -0.872 . . . . 122.81 111.319 -175.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' ARG . . . . . . . . . . . . . . . -67.32 -40.76 86.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.06 -0.656 . . . . 75.69 111.035 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ARG . . . . . 0.422 ' NH1' ' OE1' ' D' ' 33' ' ' GLU . 23.4 tpt85 -64.42 -37.94 89.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.288 -0.565 . . . . 69.38 111.144 -179.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' ARG . . . . . . . . . . . . . 22.4 ttp85 -65.54 -42.7 91.64 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 111.859 0.318 . . . . 74.9 111.859 -179.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 45.5 mt -59.11 -43.89 90.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 C-N-CA 120.034 -0.666 . . . . 94.97 110.003 175.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' GLU . . . . . 0.422 ' OE1' ' NH1' ' D' ' 30' ' ' ARG . 92.7 mt-10 -55.56 -56.33 21.54 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 120.967 0.413 . . . . 73.29 110.795 176.948 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' ILE . . . . . . . . . . . . . 62.7 mt -60.02 -44.75 95.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.619 -0.264 . . . . 51.85 111.195 -176.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.9 -55.26 28.46 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.888 0.375 . . . . 55.42 111.391 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -61.46 -38.9 88.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.437 -0.505 . . . . 56.74 111.09 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.17 82.32 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.212 -0.305 . . . . 61.52 111.525 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 92.4 mt -107.47 3.64 25.31 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 113.682 0.993 . . . . 65.26 113.682 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 10.0 m 54.35 51.54 14.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.274 1.035 . . . . 74.74 111.124 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 80.8 mt -126.19 165.64 18.53 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.993 -1.003 . . . . 78.98 108.599 175.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' THR . . . . . . . . . . . . . 51.8 m -78.12 142.79 37.84 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.492 -0.776 . . . . 76.47 108.909 179.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -53.54 -37.78 63.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.595 -0.73 . . . . 85.38 110.888 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -60.62 -39.66 89.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.502 -0.479 . . . . 83.83 111.098 174.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -65.63 -37.22 85.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.007 -0.677 . . . . 58.25 111.803 -177.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' ILE . . . . . . . . . . . . . 34.1 mm -64.67 -41.81 93.27 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 119.623 -0.831 . . . . 47.83 110.577 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . . . -57.81 -48.33 80.04 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.668 -0.413 . . . . 48.91 110.675 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' ILE . . . . . . . . . . . . . 83.5 mt -64.96 -42.51 94.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 120.815 0.34 . . . . 52.93 110.624 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -56.82 -52.23 65.88 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.79 0.328 . . . . 41.04 111.13 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -60.56 -34.1 73.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 118.626 -1.23 . . . . 50.26 110.965 178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' GLN . . . . . . . . . . . . . 62.2 tp60 -60.58 -55.47 32.92 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.634 -0.426 . . . . 71.56 110.158 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -59.27 -47.9 83.64 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.797 -0.361 . . . . 48.54 111.186 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' ARG . . . . . 0.405 ' NE ' ' OE2' ' D' ' 17' ' ' GLU . 50.0 tpt85 -61.64 -34.46 75.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.015 -0.674 . . . . 56.91 111.472 -179.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' ARG . . . . . 0.412 ' NH1' ' OP2' ' E' ' 6' ' ' ' DC' . 5.8 ttm180 -65.47 -33.04 74.99 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.086 -0.646 . . . . 64.63 110.863 175.09 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.02 -48.1 72.23 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.475 -0.49 . . . . 103.0 110.871 177.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.04 -34.27 74.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.484 -0.487 . . . . 67.23 111.372 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.63 -24.99 67.17 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 118.989 -1.084 . . . . 92.77 111.985 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -39.06 64.56 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.792 -0.363 . . . . 97.54 111.116 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . . . -69.3 -40.48 77.68 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.719 -0.392 . . . . 89.08 112.005 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -69.53 -29.13 66.66 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.347 0.499 . . . . 111.5 112.347 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.484 0.55 . . . . 115.78 112.484 176.33 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 0' ' ' ' DA' . . . . . 0.623 ' N3 ' " O5'" ' E' ' 0' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.663 0 O4'-C1'-N19 107.017 -0.979 . . . . 101.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.246 1 O4'-C1'-N19 111.496 4.62 . . . . 102.09 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.612 0 O4'-C1'-N19 110.039 2.799 . . . . 110.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.516 0 O4'-C1'-N19 109.186 1.732 . . . . 92.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.681 0 O4'-C1'-C2' 104.63 -1.337 . . . . 99.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.529 1.06 0 P-O3'-C3' 120.854 0.962 . . . . 88.14 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' ' DC' . . . . . 0.412 ' OP2' ' NH1' ' D' ' 53' ' ' ARG . . . . . . . . 0 O5'--C5' 1.402 -2.347 0 C3'-C2'-C1' 101.325 -0.982 . . . . 102.2 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' C2S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.682 0 P-O3'-C3' 122.115 2.013 . . . . 131.79 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.549 3.073 0 C1'-O4'-C4' 107.001 -1.928 . . . . 100.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.267 0 C3'-C2'-C1' 100.738 -1.402 . . . . 102.44 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.515 0 O4'-C1'-N19 109.968 2.71 . . . . 97.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.391 -3.082 0 C3'-C2'-C1' 98.962 -2.67 . . . . 89.36 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.387 -3.403 0 C3'-C2'-C1' 98.478 -3.016 . . . . 83.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.642 0 O4'-C1'-N19 108.875 1.343 . . . . 85.02 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.331 0 O4'-C1'-C2' 107.789 1.535 . . . . 35.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 C3'-C2'-C1' 99.382 -2.37 . . . . 49.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.544 2.624 0 OP1-P-OP2 122.936 2.224 . . . . 67.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.419 -1.323 0 P-O3'-C3' 122.381 2.234 . . . . 75.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 27' ' ' ' DT' . . . . . 0.499 ' O2 ' ' NH1' ' D' ' 5' ' ' ARG . . . . . . . . 0 O3'--C3' 1.403 -2.183 0 O4'-C1'-N19 110.978 3.972 . . . . 76.82 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 28' ' ' ' DA' . . . . . 0.755 ' N7 ' ' O ' ' F' ' 201' ' ' HOH . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C3'-C2'-C1' 99.722 -2.127 . . . . 58.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.554 3.577 0 C1'-O4'-C4' 107.225 -1.768 . . . . 63.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.542 2.449 0 P-O3'-C3' 122.026 1.938 . . . . 84.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.618 0 O4'-C1'-N19 109.1 1.625 . . . . 125.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.417 -1.094 0 O4'-C1'-N19 109.456 2.07 . . . . 123.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 33' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.619 0 O4'-C1'-C2' 107.912 1.647 . . . . 118.52 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 34' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.535 1.667 0 C3'-C2'-C1' 101.039 -1.186 . . . . 124.08 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.535 0 C3'-C2'-C1' 100.571 -1.521 . . . . 108.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.533 1.548 0 C3'-C2'-C1' 99.365 -2.382 . . . . 113.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.184 0 C3'-C2'-C1' 100.072 -1.877 . . . . 111.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . 0.456 ' O ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 201' ' ' HOH . . . . . 0.755 ' O ' ' N7 ' ' F' ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.558 -0.164 . . . . 125.05 110.558 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -108.77 -52.49 2.76 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.018 0.747 . . . . 130.47 113.018 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.17 149.95 11.73 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.504 -0.855 . . . . 102.93 111.957 177.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 0.533 ' NH1' ' O2 ' ' C' ' 27' ' ' ' DT' . 20.1 ttt180 -159.34 131.89 6.73 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.339 -0.615 . . . . 69.41 109.339 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -108.01 129.81 55.1 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.769 -0.826 . . . . 70.08 108.769 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.1 p -96.33 132.3 41.97 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.738 -0.838 . . . . 64.5 108.738 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -82.65 135.38 35.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.099 0.476 . . . . 57.44 110.345 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -63.81 171.26 2.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.798 0.809 . . . . 55.8 110.19 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -64.56 -37.38 87.35 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.114 -1.034 . . . . 107.52 110.602 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -65.44 -49.14 70.29 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.911 0.386 . . . . 72.09 110.777 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -58.84 -52.72 64.53 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.71 0.291 . . . . 57.17 111.107 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.9 m -58.93 -32.24 69.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.359 -0.536 . . . . 44.21 111.418 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -71.89 -54.67 9.34 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.774 0.321 . . . . 66.05 110.794 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -55.04 -43.04 73.38 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.653 -0.419 . . . . 60.36 110.968 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.76 -47.47 85.06 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 120.743 0.306 . . . . 38.77 111.398 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -63.41 -32.68 74.18 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.483 -0.887 . . . . 69.66 111.23 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -62.29 -53.23 58.11 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 121.024 -0.27 . . . . 46.67 110.953 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 34' ' ' ILE . 29.9 tp10 -57.91 -37.51 74.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.96 -0.696 . . . . 66.45 111.435 179.042 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . 0.538 ' CZ ' ' HG3' ' A' ' 24' ' ' ARG . 63.5 t80 -67.28 -20.98 65.71 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.497 0.554 . . . . 55.46 112.497 -178.027 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -65.1 -26.06 68.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.363 -0.535 . . . . 66.75 111.531 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -100.47 -51.21 3.68 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 112.828 0.677 . . . . 60.95 112.828 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -118.51 105.05 11.26 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.208 -1.034 . . . . 57.75 108.208 -176.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ARG . . . . . 0.538 ' HG3' ' CZ ' ' A' ' 20' ' ' PHE . 83.5 mtm-85 -67.02 -22.43 65.89 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 118.814 -1.154 . . . . 51.53 112.191 176.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . 0.539 ' OH ' ' OP1' ' B' ' 6' ' ' ' DC' . 84.3 m-85 -126.53 152.09 47.0 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.813 0.845 . . . . 44.16 109.188 171.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.657 HD23 ' HG2' ' A' ' 31' ' ' ARG . 2.7 tp -123.41 138.04 54.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.252 -0.431 . . . . 55.22 111.713 -171.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.6 p -80.55 163.06 23.99 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.459 0.647 . . . . 43.98 109.748 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.1 ttt-85 -62.26 -37.77 86.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.193 -1.003 . . . . 81.47 110.998 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -66.05 -39.95 90.54 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.286 -0.966 . . . . 56.69 110.942 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' NH1' ' OE1' ' A' ' 33' ' ' GLU . 24.0 tpt85 -65.61 -35.87 82.08 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.689 -0.804 . . . . 76.96 111.158 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.657 ' HG2' HD23 ' A' ' 26' ' ' LEU . 45.2 mtm-85 -65.35 -43.69 90.07 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 120.062 -0.655 . . . . 62.66 111.74 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.91 -42.59 89.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 119.56 -0.856 . . . . 48.3 110.665 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . 0.464 ' OE1' ' NH1' ' A' ' 30' ' ' ARG . 91.5 mt-10 -55.37 -57.45 11.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.893 -0.505 . . . . 66.42 111.078 177.004 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . 0.633 HD12 HD21 ' A' ' 26' ' ' LEU . 59.6 mt -58.82 -42.28 85.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 120.926 0.393 . . . . 42.06 110.508 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.9 -55.04 26.19 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.104 -0.372 . . . . 50.34 110.992 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -62.23 -39.22 92.09 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 72.98 111.029 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.44 78.23 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 122.291 -0.256 . . . . 55.71 111.663 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.7 mt -109.47 4.17 22.07 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.422 0.897 . . . . 51.14 113.422 -173.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.6 m 56.68 52.82 9.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.094 0.95 . . . . 52.73 110.976 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.3 mt -127.33 165.11 20.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.836 0.827 . . . . 63.46 109.138 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . 0.653 HG22 ' H ' ' A' ' 43' ' ' ARG . 25.5 m -82.46 146.55 29.21 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.091 -0.959 . . . . 55.03 110.597 177.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -51.88 -42.81 62.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.614 -0.721 . . . . 80.57 111.162 171.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.653 ' H ' HG22 ' A' ' 41' ' ' THR . 53.6 ttt85 -60.81 -41.43 95.67 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.838 -0.345 . . . . 88.36 111.402 176.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.513 ' HG3' ' HB ' ' A' ' 41' ' ' THR . 45.5 mt-30 -66.41 -37.91 86.29 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.315 -0.554 . . . . 53.13 111.13 -179.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.92 -42.06 93.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 120.655 -0.418 . . . . 39.86 110.516 175.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.1 -50.36 73.03 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.561 -0.456 . . . . 73.16 110.75 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.9 mt -64.58 -42.29 94.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 120.798 0.332 . . . . 54.78 111.107 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -56.37 -52.8 63.27 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.084 -0.646 . . . . 41.1 110.989 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -58.6 -33.94 70.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.589 -0.844 . . . . 34.26 111.384 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.66 -54.27 41.99 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.504 -0.879 . . . . 50.89 111.187 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.58 -48.27 82.53 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.18 -0.608 . . . . 49.84 111.015 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 -59.36 -32.11 69.81 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.916 -0.714 . . . . 51.75 111.413 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -66.52 -35.34 80.01 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.818 -0.753 . . . . 50.15 111.288 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 59.2 mmm -66.89 -44.35 81.08 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 121.169 -0.212 . . . . 104.96 110.951 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . . . -60.53 -36.33 78.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.192 -0.603 . . . . 77.23 111.291 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -67.95 -26.29 65.87 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.542 0.571 . . . . 96.31 112.542 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -77.01 -41.92 40.77 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.262 -0.575 . . . . 110.84 111.96 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -67.64 -38.83 84.41 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.501 -0.48 . . . . 103.09 111.239 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -70.8 -27.58 64.0 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.709 -0.397 . . . . 109.99 111.768 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 121.25 0.548 . . . . 110.11 112.054 176.248 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 0' ' ' ' DA' . . . . . 0.422 ' N3 ' " O5'" ' B' ' 0' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.246 0 O4'-C1'-N19 108.558 0.947 . . . . 54.3 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.402 -2.356 0 C3'-C2'-C1' 99.71 -2.136 . . . . 70.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O5'--C5' 1.364 -4.765 0 O4'-C1'-N19 106.315 -1.856 . . . . 54.54 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.097 0 C3'-C2'-C1' 100.029 -1.908 . . . . 64.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.317 0 OP1-P-OP2 121.682 1.388 . . . . 71.19 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.36 0 P-O3'-C3' 121.811 1.759 . . . . 50.09 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' ' DC' . . . . . 0.539 ' OP1' ' OH ' ' A' ' 25' ' ' TYR . . . . . . . . 0 O3'--C3' 1.4 -2.364 0 OP1-P-OP2 121.67 1.38 . . . . 69.4 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' C2S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.804 0 P-O3'-C3' 123.616 3.264 . . . . 101.98 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.543 2.479 0 O4'-C1'-N19 109.685 2.356 . . . . 104.56 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.6 0 C3'-C2'-C1' 100.749 -1.393 . . . . 95.9 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.266 0 C3'-C2'-C1' 99.197 -2.502 . . . . 88.76 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.396 -2.696 0 C3'-C2'-C1' 98.756 -2.817 . . . . 101.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.74 0 C3'-C2'-C1' 99.195 -2.504 . . . . 91.13 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 P-O3'-C3' 121.4 1.417 . . . . 100.63 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.477 3.535 0 O4'-C1'-C2' 108.23 1.936 . . . . 90.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.056 1 P-O3'-C3' 124.911 4.343 . . . . 96.19 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.21 0 P-O5'-C5' 117.643 -2.036 . . . . 95.72 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.415 -1.238 0 P-O3'-C3' 121.161 1.217 . . . . 102.26 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 27' ' ' ' DT' . . . . . 0.533 ' O2 ' ' NH1' ' A' ' 5' ' ' ARG . . . . . . . . 0 O3'--C3' 1.394 -2.864 0 O4'-C1'-N19 110.54 3.425 . . . . 72.26 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.201 0 C3'-C2'-C1' 100.484 -1.583 . . . . 51.05 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.548 2.99 0 C1'-O4'-C4' 107.007 -1.923 . . . . 51.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.157 0 C4'-C3'-C2' 104.911 1.711 . . . . 81.33 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.291 0 C3'-C2'-C1' 101.214 -1.061 . . . . 102.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.528 1.006 0 O4'-C1'-N19 109.044 1.555 . . . . 98.1 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.359 0 C4'-C3'-C2' 105.216 2.016 . . . . 93.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 34' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.526 0 C3'-C2'-C1' 100.997 -1.217 . . . . 90.4 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.581 0 C3'-C2'-C1' 100.745 -1.396 . . . . 90.43 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.399 -2.433 0 O4'-C1'-C2' 103.841 -2.054 . . . . 61.56 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.156 0 OP1-P-OP2 122.179 1.719 . . . . 62.97 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 . . . . . 0 C--O 1.238 0.449 0 N-CA-C 113.274 0.842 . . . . 79.47 113.274 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 6' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -108.38 129.26 55.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.639 0.776 . . . . 99.58 109.468 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 37.6 p -97.87 131.81 44.02 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.21 0.604 . . . . 81.89 110.039 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -83.75 136.53 34.13 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.352 0.596 . . . . 66.03 112.128 -170.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' THR . . . . . . . . . . . . . 11.2 p -63.22 168.76 4.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.979 0.895 . . . . 58.66 110.54 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.4 -38.9 81.76 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.359 -0.837 . . . . 63.59 110.802 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.7 -49.17 71.94 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.365 -0.534 . . . . 60.18 111.03 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -59.32 -53.01 63.14 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.564 -0.455 . . . . 69.05 111.496 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -60.0 -33.1 71.52 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.121 -0.631 . . . . 41.05 111.729 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 35.9 tp -73.57 -53.76 9.76 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.137 -0.625 . . . . 47.55 110.851 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -52.64 -43.51 65.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.737 -0.385 . . . . 68.66 111.565 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.4 -44.07 97.3 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 121.023 -0.271 . . . . 45.55 111.383 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -63.26 -35.45 80.4 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.245 -0.582 . . . . 72.29 111.206 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -64.18 -48.1 77.26 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.786 0.327 . . . . 48.12 110.76 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -54.05 -39.72 66.49 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.718 0.294 . . . . 71.61 111.076 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -69.51 -22.32 63.6 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.521 0.563 . . . . 61.18 112.521 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -65.79 -25.2 67.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.352 -0.539 . . . . 58.09 111.301 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -100.06 -52.38 3.43 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.65 0.611 . . . . 75.85 112.65 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -120.34 103.57 9.32 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.006 -0.738 . . . . 83.77 109.006 -174.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -61.92 -19.77 63.07 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.837 -0.745 . . . . 71.39 111.797 172.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -125.09 153.78 42.42 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.576 -0.898 . . . . 69.48 108.576 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' LEU . . . . . 0.685 HD21 HD12 ' D' ' 34' ' ' ILE . 2.9 tp -119.99 135.21 55.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.74 -0.664 . . . . 75.98 110.511 -171.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 56.8 p -81.07 162.56 23.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.835 0.826 . . . . 77.16 110.442 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' ARG . . . . . 0.428 ' O ' HG13 ' D' ' 32' ' ' ILE . 14.4 tpt85 -63.3 -38.59 91.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.282 -0.872 . . . . 122.81 111.319 -175.558 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' ARG . . . . . . . . . . . . . . . -67.32 -40.76 86.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.06 -0.656 . . . . 75.69 111.035 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ARG . . . . . 0.422 ' NH1' ' OE1' ' D' ' 33' ' ' GLU . 23.4 tpt85 -64.42 -37.94 89.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.288 -0.565 . . . . 69.38 111.144 -179.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' ARG . . . . . 0.416 ' HG2' ' HG3' ' D' ' 42' ' ' GLU . 22.4 ttp85 -65.54 -42.7 91.64 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 111.859 0.318 . . . . 74.9 111.859 -179.864 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ILE . . . . . 0.428 HG13 ' O ' ' D' ' 28' ' ' ARG . 45.5 mt -59.11 -43.89 90.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 C-N-CA 120.034 -0.666 . . . . 94.97 110.003 175.747 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 33' ' ' GLU . . . . . 0.422 ' OE1' ' NH1' ' D' ' 30' ' ' ARG . 92.7 mt-10 -55.56 -56.33 21.54 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 120.967 0.413 . . . . 73.29 110.795 176.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 34' ' ' ILE . . . . . 0.685 HD12 HD21 ' D' ' 26' ' ' LEU . 62.7 mt -60.02 -44.75 95.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.619 -0.264 . . . . 51.85 111.195 -176.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.9 -55.26 28.46 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.888 0.375 . . . . 55.42 111.391 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 36' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -61.46 -38.9 88.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.437 -0.505 . . . . 58.65 111.09 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.17 82.32 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.212 -0.305 . . . . 61.52 111.525 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 92.4 mt -107.47 3.64 25.31 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 113.682 0.993 . . . . 65.26 113.682 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 10.0 m 54.35 51.54 14.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.274 1.035 . . . . 74.74 111.124 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 80.8 mt -126.19 165.64 18.53 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.993 -1.003 . . . . 78.98 108.599 175.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' THR . . . . . 0.67 HG22 ' H ' ' D' ' 43' ' ' ARG . 51.8 m -78.12 142.79 37.84 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.492 -0.776 . . . . 76.47 108.909 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 42' ' ' GLU . . . . . 0.416 ' HG3' ' HG2' ' D' ' 31' ' ' ARG . 42.0 tt0 -53.54 -37.78 63.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.595 -0.73 . . . . 85.38 110.888 173.152 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 43' ' ' ARG . . . . . 0.67 ' H ' HG22 ' D' ' 41' ' ' THR . 54.5 ttt85 -60.62 -39.66 89.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.502 -0.479 . . . . 83.83 111.098 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 44' ' ' GLN . . . . . 0.579 ' HG3' ' HB ' ' D' ' 41' ' ' THR . 47.3 mt-30 -65.63 -37.22 85.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.007 -0.677 . . . . 58.25 111.803 -177.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 45' ' ' ILE . . . . . . . . . . . . . 34.1 mm -64.67 -41.81 93.27 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 119.623 -0.831 . . . . 47.83 110.577 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . . . -57.81 -48.33 80.04 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.668 -0.413 . . . . 48.91 110.675 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' ILE . . . . . . . . . . . . . 83.5 mt -64.96 -42.51 94.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 120.815 0.34 . . . . 52.93 110.624 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -56.82 -52.23 65.88 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.79 0.328 . . . . 41.04 111.13 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 49' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' D' ' 53' ' ' ARG . 12.9 m-85 -60.56 -34.1 73.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 118.626 -1.23 . . . . 50.26 110.965 178.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 50' ' ' GLN . . . . . . . . . . . . . 62.2 tp60 -60.58 -55.47 32.92 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.634 -0.426 . . . . 71.56 110.158 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -59.27 -47.9 83.64 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.797 -0.361 . . . . 48.54 111.186 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' ARG . . . . . . . . . . . . . 50.0 tpt85 -61.64 -34.46 75.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.015 -0.674 . . . . 56.91 111.472 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' D' ' 49' ' ' PHE . 5.8 ttm180 -65.47 -33.04 74.99 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.086 -0.646 . . . . 64.63 110.863 175.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' MET . . . . . 0.469 ' HE1' ' S2P' ' E' ' 7' ' ' C2S . 0.1 OUTLIER -66.02 -48.1 72.23 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.475 -0.49 . . . . 103.0 110.871 177.834 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 55' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.04 -34.27 74.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.484 -0.487 . . . . 67.23 111.372 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.63 -24.99 67.17 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 118.989 -1.084 . . . . 92.77 111.985 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -39.06 64.56 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.792 -0.363 . . . . 97.54 111.116 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . . . -69.3 -40.48 77.68 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.719 -0.392 . . . . 89.08 112.005 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -69.53 -29.13 66.66 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.347 0.499 . . . . 111.5 112.347 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.484 0.55 . . . . 115.78 112.484 176.33 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 0' ' ' ' DA' . . . . . 0.531 ' N3 ' " O5'" ' E' ' 0' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.663 0 O4'-C1'-N19 107.017 -0.979 . . . . 101.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.246 1 O4'-C1'-N19 111.496 4.62 . . . . 102.09 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.612 0 O4'-C1'-N19 110.039 2.799 . . . . 110.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.516 0 O4'-C1'-N19 109.186 1.732 . . . . 92.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.681 0 O4'-C1'-C2' 104.63 -1.337 . . . . 99.88 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.529 1.06 0 P-O3'-C3' 120.854 0.962 . . . . 88.14 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 6' ' ' ' DC' . . . . . 0.412 ' OP2' ' NH1' ' D' ' 53' ' ' ARG . . . . . . . . 0 O5'--C5' 1.402 -2.347 0 C3'-C2'-C1' 101.325 -0.982 . . . . 102.2 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 7' ' ' C2S . . . . . 0.469 ' S2P' ' HE1' ' D' ' 54' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 8' ' ' ' DA' . . . . . 0.443 ' C8 ' H2'1 ' E' ' 7' ' ' C2S . . . . . . . . 0 C3'--C2' 1.535 1.682 0 P-O3'-C3' 122.115 2.013 . . . . 131.79 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.549 3.073 0 C1'-O4'-C4' 107.001 -1.928 . . . . 100.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.267 0 C3'-C2'-C1' 100.738 -1.402 . . . . 102.44 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.515 0 O4'-C1'-N19 109.968 2.71 . . . . 97.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.391 -3.082 0 C3'-C2'-C1' 98.962 -2.67 . . . . 89.36 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.387 -3.403 0 C3'-C2'-C1' 98.478 -3.016 . . . . 83.42 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.642 0 O4'-C1'-N19 108.875 1.343 . . . . 85.02 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.331 0 O4'-C1'-C2' 107.789 1.535 . . . . 35.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 C3'-C2'-C1' 99.382 -2.37 . . . . 49.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.544 2.624 0 OP1-P-OP2 122.936 2.224 . . . . 67.68 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.419 -1.323 0 P-O3'-C3' 122.381 2.234 . . . . 75.2 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 27' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.403 -2.183 0 O4'-C1'-N19 110.978 3.972 . . . . 76.82 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 28' ' ' ' DA' . . . . . 0.755 ' N7 ' ' O ' ' F' ' 201' ' ' HOH . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C3'-C2'-C1' 99.722 -2.127 . . . . 58.11 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.554 3.577 0 C1'-O4'-C4' 107.225 -1.768 . . . . 63.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.542 2.449 0 P-O3'-C3' 122.026 1.938 . . . . 84.18 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.618 0 O4'-C1'-N19 109.1 1.625 . . . . 125.51 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.417 -1.094 0 O4'-C1'-N19 109.456 2.07 . . . . 123.07 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 33' ' ' ' DC' . . . . . 0.436 " H2'" ' C6 ' ' F' ' 34' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.619 0 O4'-C1'-C2' 107.912 1.647 . . . . 118.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 34' ' ' ' DT' . . . . . 0.436 ' C6 ' " H2'" ' F' ' 33' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.535 1.667 0 C3'-C2'-C1' 101.039 -1.186 . . . . 124.08 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.535 0 C3'-C2'-C1' 100.571 -1.521 . . . . 108.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.533 1.548 0 C3'-C2'-C1' 99.365 -2.382 . . . . 113.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.184 0 C3'-C2'-C1' 100.072 -1.877 . . . . 111.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' MPD . . . . . 0.507 ' H13' ' H11' ' F' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 101' ' ' MPD . . . . . 0.507 ' H11' ' H13' ' D' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . 0.456 ' O ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 201' ' ' HOH . . . . . 0.755 ' O ' ' N7 ' ' F' ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.324 0 N-CA-C 110.558 -0.164 . . . . 125.05 110.558 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -108.77 -52.49 2.76 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.018 0.747 . . . . 130.47 113.018 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 111.17 149.95 11.73 Favored Glycine 0 N--CA 1.449 -0.489 0 C-N-CA 120.504 -0.855 . . . . 102.93000000000001 111.957 177.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.533 ' NH1' ' O2 ' ' C' ' 27' ' ' ' DT' . 20.1 ttt180 -159.34 131.89 6.73 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 109.339 -0.615 . . . . 69.409999999999997 109.339 -179.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -108.01 129.81 55.1 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.769 -0.826 . . . . 70.079999999999998 108.769 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 69.1 p -96.33 132.3 41.97 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 108.738 -0.838 . . . . 64.5 108.738 -178.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 21.7 m-30 -82.65 135.38 35.05 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.099 0.476 . . . . 57.439999999999998 110.345 -171.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 16.8 p -63.81 171.26 2.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 121.798 0.809 . . . . 55.799999999999997 110.19 -177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 51.9 ttt85 -64.56 -37.38 87.35 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.114 -1.034 . . . . 107.52 110.602 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 84.3 t80 -65.44 -49.14 70.29 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-O 120.911 0.386 . . . . 72.090000000000003 110.777 -179.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 98.3 mt-30 -58.84 -52.72 64.53 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 120.71 0.291 . . . . 57.170000000000002 111.107 -178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 85.9 m -58.93 -32.24 69.4 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.359 -0.536 . . . . 44.210000000000001 111.418 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 48.8 tp -71.89 -54.67 9.34 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.774 0.321 . . . . 66.049999999999997 110.794 -179.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 62.4 mm-40 -55.04 -43.04 73.38 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 120.653 -0.419 . . . . 60.359999999999999 110.968 178.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 75.0 mt -61.76 -47.47 85.06 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 120.743 0.306 . . . . 38.770000000000003 111.398 177.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 25.3 tp10 -63.41 -32.68 74.18 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 119.483 -0.887 . . . . 69.659999999999997 111.23 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 6.3 tttt -62.29 -53.23 58.11 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 121.024 -0.27 . . . . 46.670000000000002 110.953 176.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.495 ' HG2' HD11 ' A' ' 34' ' ' ILE . 29.9 tp10 -57.91 -37.51 74.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.96 -0.696 . . . . 66.450000000000003 111.435 179.042 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.538 ' CZ ' ' HG3' ' A' ' 24' ' ' ARG . 63.5 t80 -67.28 -20.98 65.71 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 112.497 0.554 . . . . 55.460000000000001 112.497 -178.027 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -65.1 -26.06 68.05 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 120.363 -0.535 . . . . 66.75 111.531 177.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -100.47 -51.21 3.68 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 112.828 0.677 . . . . 60.950000000000003 112.828 -178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 78.6 m-20 -118.51 105.05 11.26 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 108.208 -1.034 . . . . 57.75 108.208 -176.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.538 ' HG3' ' CZ ' ' A' ' 20' ' ' PHE . 83.5 mtm-85 -67.02 -22.43 65.89 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 118.814 -1.154 . . . . 51.530000000000001 112.191 176.139 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.539 ' OH ' ' OP1' ' B' ' 6' ' ' ' DC' . 84.3 m-85 -126.53 152.09 47.0 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 123.813 0.845 . . . . 44.159999999999997 109.188 171.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.657 HD23 ' HG2' ' A' ' 31' ' ' ARG . 2.7 tp -123.41 138.04 54.68 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 116.252 -0.431 . . . . 55.219999999999999 111.713 -171.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 71.6 p -80.55 163.06 23.99 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.459 0.647 . . . . 43.979999999999997 109.748 172.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 61.1 ttt-85 -62.26 -37.77 86.71 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.193 -1.003 . . . . 81.469999999999999 110.998 -174.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 42.8 ttm180 -66.05 -39.95 90.54 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.286 -0.966 . . . . 56.689999999999998 110.942 178.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.464 ' NH1' ' OE1' ' A' ' 33' ' ' GLU . 24.0 tpt85 -65.61 -35.87 82.08 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.689 -0.804 . . . . 76.959999999999994 111.158 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.657 ' HG2' HD23 ' A' ' 26' ' ' LEU . 45.2 mtm-85 -65.35 -43.69 90.07 Favored 'General case' 0 C--N 1.342 0.254 0 C-N-CA 120.062 -0.655 . . . . 62.659999999999997 111.74 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 66.8 mt -59.91 -42.59 89.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 119.56 -0.856 . . . . 48.299999999999997 110.665 177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.464 ' OE1' ' NH1' ' A' ' 30' ' ' ARG . 91.5 mt-10 -55.37 -57.45 11.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 121.893 -0.505 . . . . 66.420000000000002 111.078 177.004 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.633 HD12 HD21 ' A' ' 26' ' ' LEU . 59.6 mt -58.82 -42.28 85.13 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 120.926 0.393 . . . . 42.060000000000002 110.508 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.9 -55.04 26.19 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 122.104 -0.372 . . . . 50.340000000000003 110.992 178.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 34.6 m170 -62.23 -39.22 92.09 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.341 -0.544 . . . . 72.980000000000004 111.029 179.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.82 -35.44 78.23 Favored 'General case' 0 C--O 1.236 0.372 0 O-C-N 122.291 -0.256 . . . . 55.710000000000001 111.663 -177.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 81.7 mt -109.47 4.17 22.07 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.422 0.897 . . . . 51.140000000000001 113.422 -173.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 6.6 m 56.68 52.82 9.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-O 122.094 0.95 . . . . 52.729999999999997 110.976 -174.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.3 mt -127.33 165.11 20.34 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.836 0.827 . . . . 63.460000000000001 109.138 173.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . 0.653 HG22 ' H ' ' A' ' 43' ' ' ARG . 25.5 m -82.46 146.55 29.21 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.091 -0.959 . . . . 55.030000000000001 110.597 177.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -51.88 -42.81 62.96 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.614 -0.721 . . . . 80.569999999999993 111.162 171.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.653 ' H ' HG22 ' A' ' 41' ' ' THR . 53.6 ttt85 -60.81 -41.43 95.67 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 120.838 -0.345 . . . . 88.359999999999999 111.402 176.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.513 ' HG3' ' HB ' ' A' ' 41' ' ' THR . 45.5 mt-30 -66.41 -37.91 86.29 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.315 -0.554 . . . . 53.130000000000003 111.13 -179.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 39.6 mm -64.92 -42.06 93.79 Favored 'Isoleucine or valine' 0 C--O 1.24 0.59 0 C-N-CA 120.655 -0.418 . . . . 39.859999999999999 110.516 175.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -57.1 -50.36 73.03 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.561 -0.456 . . . . 73.159999999999997 110.75 178.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 76.9 mt -64.58 -42.29 94.7 Favored 'Isoleucine or valine' 0 C--O 1.242 0.659 0 CA-C-O 120.798 0.332 . . . . 54.780000000000001 111.107 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 56.4 t90 -56.37 -52.8 63.27 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 120.084 -0.646 . . . . 41.100000000000001 110.989 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 10.1 m-85 -58.6 -33.94 70.56 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.589 -0.844 . . . . 34.259999999999998 111.384 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 58.2 tp60 -62.66 -54.27 41.99 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.504 -0.879 . . . . 50.890000000000001 111.187 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 90.1 m-20 -60.58 -48.27 82.53 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.18 -0.608 . . . . 49.840000000000003 111.015 -179.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 51.7 tpt85 -59.36 -32.11 69.81 Favored 'General case' 0 C--O 1.238 0.483 0 C-N-CA 119.916 -0.714 . . . . 51.75 111.413 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.7 ttm180 -66.52 -35.34 80.01 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.818 -0.753 . . . . 50.149999999999999 111.288 175.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 59.2 mmm -66.89 -44.35 81.08 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 121.169 -0.212 . . . . 104.95999999999999 110.951 -178.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . . . -60.53 -36.33 78.15 Favored 'General case' 0 C--O 1.235 0.339 0 C-N-CA 120.192 -0.603 . . . . 77.230000000000004 111.291 176.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TRP . . . . . . . . . . . . . 79.9 t90 -67.95 -26.29 65.87 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.542 0.571 . . . . 96.310000000000002 112.542 -178.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -77.01 -41.92 40.77 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.262 -0.575 . . . . 110.84 111.96 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 84.5 mttt -67.64 -38.83 84.41 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.501 -0.48 . . . . 103.09 111.239 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -70.8 -27.58 64.0 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 120.709 -0.397 . . . . 109.98999999999999 111.768 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 12.0 m-20 . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 121.25 0.548 . . . . 110.11 112.054 176.248 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 0' ' ' ' DA' . . . . . 0.422 ' N3 ' " O5'" ' B' ' 0' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.246 0 O4'-C1'-N19 108.558 0.947 . . . . 54.299999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.402 -2.356 0 C3'-C2'-C1' 99.71 -2.136 . . . . 70.0 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 1 O5'--C5' 1.364 -4.765 0 O4'-C1'-N19 106.315 -1.856 . . . . 54.539999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.097 0 C3'-C2'-C1' 100.029 -1.908 . . . . 64.069999999999993 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.403 -2.317 0 OP1-P-OP2 121.682 1.388 . . . . 71.189999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.36 0 P-O3'-C3' 121.811 1.759 . . . . 50.090000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.539 ' OP1' ' OH ' ' A' ' 25' ' ' TYR . . . . . . . . 0 O3'--C3' 1.4 -2.364 0 OP1-P-OP2 121.67 1.38 . . . . 69.400000000000006 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' C2S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.536 1.804 0 P-O3'-C3' 123.616 3.264 . . . . 101.98 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.543 2.479 0 O4'-C1'-N19 109.685 2.356 . . . . 104.56 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.6 0 C3'-C2'-C1' 100.749 -1.393 . . . . 95.900000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.266 0 C3'-C2'-C1' 99.197 -2.502 . . . . 88.760000000000005 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.396 -2.696 0 C3'-C2'-C1' 98.756 -2.817 . . . . 101.95 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.74 0 C3'-C2'-C1' 99.195 -2.504 . . . . 91.129999999999995 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.24 0 P-O3'-C3' 121.4 1.417 . . . . 100.63 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.477 3.535 0 O4'-C1'-C2' 108.23 1.936 . . . . 90.480000000000004 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.404 -2.056 1 P-O3'-C3' 124.911 4.343 . . . . 96.189999999999998 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.21 0 P-O5'-C5' 117.643 -2.036 . . . . 95.719999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.415 -1.238 0 P-O3'-C3' 121.161 1.217 . . . . 102.26000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' ' DT' . . . . . 0.533 ' O2 ' ' NH1' ' A' ' 5' ' ' ARG . . . . . . . . 0 O3'--C3' 1.394 -2.864 0 O4'-C1'-N19 110.54 3.425 . . . . 72.260000000000005 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.201 0 C3'-C2'-C1' 100.484 -1.583 . . . . 51.049999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.548 2.99 0 C1'-O4'-C4' 107.007 -1.923 . . . . 51.420000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.54 2.157 0 C4'-C3'-C2' 104.911 1.711 . . . . 81.329999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.291 0 C3'-C2'-C1' 101.214 -1.061 . . . . 102.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.528 1.006 0 O4'-C1'-N19 109.044 1.555 . . . . 98.099999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.4 -2.359 0 C4'-C3'-C2' 105.216 2.016 . . . . 93.939999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.526 0 C3'-C2'-C1' 100.997 -1.217 . . . . 90.400000000000006 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.415 -1.581 0 C3'-C2'-C1' 100.745 -1.396 . . . . 90.430000000000007 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.399 -2.433 0 O4'-C1'-C2' 103.841 -2.054 . . . . 61.560000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.156 0 OP1-P-OP2 122.179 1.719 . . . . 62.969999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ARG . . . . . . . . . . . . . 19.9 ttt180 . . . . . 0 C--O 1.238 0.449 0 N-CA-C 113.274 0.842 . . . . 79.469999999999999 113.274 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -108.38 129.26 55.25 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.639 0.776 . . . . 99.579999999999998 109.468 -178.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 37.6 p -97.87 131.81 44.02 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.21 0.604 . . . . 81.890000000000001 110.039 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' TYR . . . . . . . . . . . . . 21.1 m-30 -83.75 136.53 34.13 Favored 'General case' 0 C--O 1.238 0.458 0 CA-C-O 121.352 0.596 . . . . 66.030000000000001 112.128 -170.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' THR . . . . . . . . . . . . . 11.2 p -63.22 168.76 4.01 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.979 0.895 . . . . 58.659999999999997 110.54 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' ARG . . . . . . . . . . . . . 53.8 ttt85 -59.4 -38.9 81.76 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.359 -0.837 . . . . 63.590000000000003 110.802 177.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' TYR . . . . . . . . . . . . . 84.5 t80 -64.7 -49.17 71.94 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.365 -0.534 . . . . 60.18 111.03 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -59.32 -53.01 63.14 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 120.564 -0.455 . . . . 69.049999999999997 111.496 -177.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' THR . . . . . . . . . . . . . 90.3 m -60.0 -33.1 71.52 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.121 -0.631 . . . . 41.049999999999997 111.729 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' LEU . . . . . . . . . . . . . 35.9 tp -73.57 -53.76 9.76 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.137 -0.625 . . . . 47.549999999999997 110.851 -177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' GLU . . . . . . . . . . . . . 56.6 mm-40 -52.64 -43.51 65.51 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.737 -0.385 . . . . 68.659999999999997 111.565 177.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LEU . . . . . . . . . . . . . 80.2 mt -62.4 -44.07 97.3 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 121.023 -0.271 . . . . 45.549999999999997 111.383 175.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -63.26 -35.45 80.4 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.245 -0.582 . . . . 72.290000000000006 111.206 179.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -64.18 -48.1 77.26 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-O 120.786 0.327 . . . . 48.119999999999997 110.76 175.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . 28.0 tp10 -54.05 -39.72 66.49 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-O 120.718 0.294 . . . . 71.609999999999999 111.076 178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -69.51 -22.32 63.6 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 112.521 0.563 . . . . 61.18 112.521 -179.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' HIS . . . . . . . . . . . . . 30.3 t-80 -65.79 -25.2 67.14 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.352 -0.539 . . . . 58.090000000000003 111.301 177.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' PHE . . . . . . . . . . . . . 85.1 m-85 -100.06 -52.38 3.43 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.65 0.611 . . . . 75.849999999999994 112.65 -179.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' ASN . . . . . . . . . . . . . 66.8 m-20 -120.34 103.57 9.32 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.006 -0.738 . . . . 83.769999999999996 109.006 -174.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -61.92 -19.77 63.07 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 119.837 -0.745 . . . . 71.390000000000001 111.797 172.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -125.09 153.78 42.42 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 108.576 -0.898 . . . . 69.480000000000004 108.576 176.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' LEU . . . . . 0.685 HD21 HD12 ' D' ' 34' ' ' ILE . 2.9 tp -119.99 135.21 55.0 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 115.74 -0.664 . . . . 75.980000000000004 110.511 -171.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . . . . . . . . . 56.8 p -81.07 162.56 23.69 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.835 0.826 . . . . 77.159999999999997 110.442 173.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' ARG . . . . . 0.428 ' O ' HG13 ' D' ' 32' ' ' ILE . 14.4 tpt85 -63.3 -38.59 91.74 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.282 -0.872 . . . . 122.81 111.319 -175.558 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' ARG . . . . . . . . . . . . . . . -67.32 -40.76 86.0 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 120.06 -0.656 . . . . 75.689999999999998 111.035 179.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ARG . . . . . 0.422 ' NH1' ' OE1' ' D' ' 33' ' ' GLU . 23.4 tpt85 -64.42 -37.94 89.3 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.288 -0.565 . . . . 69.379999999999995 111.144 -179.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' ARG . . . . . 0.416 ' HG2' ' HG3' ' D' ' 42' ' ' GLU . 22.4 ttp85 -65.54 -42.7 91.64 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 111.859 0.318 . . . . 74.900000000000006 111.859 -179.864 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ILE . . . . . 0.428 HG13 ' O ' ' D' ' 28' ' ' ARG . 45.5 mt -59.11 -43.89 90.32 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 C-N-CA 120.034 -0.666 . . . . 94.969999999999999 110.003 175.747 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' GLU . . . . . 0.422 ' OE1' ' NH1' ' D' ' 30' ' ' ARG . 92.7 mt-10 -55.56 -56.33 21.54 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-O 120.967 0.413 . . . . 73.290000000000006 110.795 176.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' ILE . . . . . 0.685 HD12 HD21 ' D' ' 26' ' ' LEU . 62.7 mt -60.02 -44.75 95.45 Favored 'Isoleucine or valine' 0 C--O 1.24 0.581 0 CA-C-N 116.619 -0.264 . . . . 51.850000000000001 111.195 -176.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.9 -55.26 28.46 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-O 120.888 0.375 . . . . 55.420000000000002 111.391 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' HIS . . . . . . . . . . . . . 83.6 t60 -61.46 -38.9 88.91 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.437 -0.505 . . . . 58.649999999999999 111.09 177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' ALA . . . . . . . . . . . . . . . -61.33 -37.17 82.32 Favored 'General case' 0 C--O 1.235 0.325 0 O-C-N 122.212 -0.305 . . . . 61.520000000000003 111.525 -177.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' LEU . . . . . . . . . . . . . 92.4 mt -107.47 3.64 25.31 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 113.682 0.993 . . . . 65.260000000000005 113.682 -173.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' SER . . . . . . . . . . . . . 10.0 m 54.35 51.54 14.08 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-O 122.274 1.035 . . . . 74.739999999999995 111.124 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LEU . . . . . . . . . . . . . 80.8 mt -126.19 165.64 18.53 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-N 114.993 -1.003 . . . . 78.980000000000004 108.599 175.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' THR . . . . . 0.67 HG22 ' H ' ' D' ' 43' ' ' ARG . 51.8 m -78.12 142.79 37.84 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.492 -0.776 . . . . 76.469999999999999 108.909 179.289 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' GLU . . . . . 0.416 ' HG3' ' HG2' ' D' ' 31' ' ' ARG . 42.0 tt0 -53.54 -37.78 63.17 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 115.595 -0.73 . . . . 85.379999999999995 110.888 173.152 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' ARG . . . . . 0.67 ' H ' HG22 ' D' ' 41' ' ' THR . 54.5 ttt85 -60.62 -39.66 89.02 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.502 -0.479 . . . . 83.829999999999998 111.098 174.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' GLN . . . . . 0.579 ' HG3' ' HB ' ' D' ' 41' ' ' THR . 47.3 mt-30 -65.63 -37.22 85.96 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 120.007 -0.677 . . . . 58.25 111.803 -177.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' ILE . . . . . . . . . . . . . 34.1 mm -64.67 -41.81 93.27 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 C-N-CA 119.623 -0.831 . . . . 47.829999999999998 110.577 176.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' LYS . . . . . . . . . . . . . . . -57.81 -48.33 80.04 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.668 -0.413 . . . . 48.909999999999997 110.675 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' ILE . . . . . . . . . . . . . 83.5 mt -64.96 -42.51 94.96 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 CA-C-O 120.815 0.34 . . . . 52.93 110.624 -178.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' TRP . . . . . . . . . . . . . 53.2 t90 -56.82 -52.23 65.88 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-O 120.79 0.328 . . . . 41.039999999999999 111.13 -179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' PHE . . . . . 0.418 ' O ' ' HB2' ' D' ' 53' ' ' ARG . 12.9 m-85 -60.56 -34.1 73.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 C-N-CA 118.626 -1.23 . . . . 50.259999999999998 110.965 178.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' GLN . . . . . . . . . . . . . 62.2 tp60 -60.58 -55.47 32.92 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.634 -0.426 . . . . 71.560000000000002 110.158 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -59.27 -47.9 83.64 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 120.797 -0.361 . . . . 48.539999999999999 111.186 178.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' ARG . . . . . . . . . . . . . 50.0 tpt85 -61.64 -34.46 75.74 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 120.015 -0.674 . . . . 56.909999999999997 111.472 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' D' ' 49' ' ' PHE . 5.8 ttm180 -65.47 -33.04 74.99 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.086 -0.646 . . . . 64.629999999999995 110.863 175.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' MET . . . . . 0.469 ' HE1' ' S2P' ' E' ' 7' ' ' C2S . 0.1 OUTLIER -66.02 -48.1 72.23 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.475 -0.49 . . . . 103.0 110.871 177.834 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' LYS . . . . . . . . . . . . . 35.1 ttpt -61.04 -34.27 74.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.484 -0.487 . . . . 67.230000000000004 111.372 178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' TRP . . . . . . . . . . . . . 83.2 t90 -65.63 -24.99 67.17 Favored 'General case' 0 C--O 1.235 0.297 0 C-N-CA 118.989 -1.084 . . . . 92.769999999999996 111.985 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -39.06 64.56 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.792 -0.363 . . . . 97.540000000000006 111.116 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' LYS . . . . . . . . . . . . . . . -69.3 -40.48 77.68 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.719 -0.392 . . . . 89.079999999999998 112.005 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' GLU . . . . . . . . . . . . . 71.6 mt-10 -69.53 -29.13 66.66 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.347 0.499 . . . . 111.5 112.347 -175.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' ASN . . . . . . . . . . . . . 11.9 m120 . . . . . 0 C--N 1.328 -0.36 0 N-CA-C 112.484 0.55 . . . . 115.78 112.484 176.33 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 0' ' ' ' DA' . . . . . 0.531 ' N3 ' " O5'" ' E' ' 0' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.535 1.663 0 O4'-C1'-N19 107.017 -0.979 . . . . 101.66 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.246 1 O4'-C1'-N19 111.496 4.62 . . . . 102.09 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.414 -1.612 0 O4'-C1'-N19 110.039 2.799 . . . . 110.48 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.516 0 O4'-C1'-N19 109.186 1.732 . . . . 92.75 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.398 -1.681 0 O4'-C1'-C2' 104.63 -1.337 . . . . 99.879999999999995 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.529 1.06 0 P-O3'-C3' 120.854 0.962 . . . . 88.140000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' ' DC' . . . . . 0.412 ' OP2' ' NH1' ' D' ' 53' ' ' ARG . . . . . . . . 0 O5'--C5' 1.402 -2.347 0 C3'-C2'-C1' 101.325 -0.982 . . . . 102.2 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' C2S . . . . . 0.469 ' S2P' ' HE1' ' D' ' 54' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' ' DA' . . . . . 0.443 ' C8 ' H2'1 ' E' ' 7' ' ' C2S . . . . . . . . 0 C3'--C2' 1.535 1.682 0 P-O3'-C3' 122.115 2.013 . . . . 131.78999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.549 3.073 0 C1'-O4'-C4' 107.001 -1.928 . . . . 100.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.267 0 C3'-C2'-C1' 100.738 -1.402 . . . . 102.44 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.515 0 O4'-C1'-N19 109.968 2.71 . . . . 97.180000000000007 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.391 -3.082 0 C3'-C2'-C1' 98.962 -2.67 . . . . 89.359999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.387 -3.403 0 C3'-C2'-C1' 98.478 -3.016 . . . . 83.420000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.534 1.642 0 O4'-C1'-N19 108.875 1.343 . . . . 85.019999999999996 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.541 2.331 0 O4'-C1'-C2' 107.789 1.535 . . . . 35.590000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.95 0 C3'-C2'-C1' 99.382 -2.37 . . . . 49.170000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.544 2.624 0 OP1-P-OP2 122.936 2.224 . . . . 67.680000000000007 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.419 -1.323 0 P-O3'-C3' 122.381 2.234 . . . . 75.200000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 27' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.403 -2.183 0 O4'-C1'-N19 110.978 3.972 . . . . 76.819999999999993 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 28' ' ' ' DA' . . . . . 0.755 ' N7 ' ' O ' ' F' ' 201' ' ' HOH . . . . . . . . 0 C5'--C4' 1.524 1.588 0 C3'-C2'-C1' 99.722 -2.127 . . . . 58.109999999999999 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 29' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.554 3.577 0 C1'-O4'-C4' 107.225 -1.768 . . . . 63.659999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 30' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.542 2.449 0 P-O3'-C3' 122.026 1.938 . . . . 84.180000000000007 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 31' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.618 0 O4'-C1'-N19 109.1 1.625 . . . . 125.51000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 32' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.417 -1.094 0 O4'-C1'-N19 109.456 2.07 . . . . 123.06999999999999 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 33' ' ' ' DC' . . . . . 0.436 " H2'" ' C6 ' ' F' ' 34' ' ' ' DT' . . . . . . . . 0 C3'--C2' 1.534 1.619 0 O4'-C1'-C2' 107.912 1.647 . . . . 118.52 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 34' ' ' ' DT' . . . . . 0.436 ' C6 ' " H2'" ' F' ' 33' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.535 1.667 0 C3'-C2'-C1' 101.039 -1.186 . . . . 124.08 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 35' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.411 -1.535 0 C3'-C2'-C1' 100.571 -1.521 . . . . 108.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 36' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C3'--C2' 1.533 1.548 0 C3'-C2'-C1' 99.365 -2.382 . . . . 113.66 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 37' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.605 1.184 0 C3'-C2'-C1' 100.072 -1.877 . . . . 111.81 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' MPD . . . . . 0.507 ' H13' ' H11' ' F' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' ' NI' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' MPD . . . . . 0.507 ' H11' ' H13' ' D' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . 0.456 ' O ' ' NH1' ' A' ' 31' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 201' ' ' HOH . . . . . 0.755 ' O ' ' N7 ' ' F' ' 28' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_