data_1lyz_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 1lyz _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' LYS . . . . . 1.402 ' C ' ' CA ' ' A' ' 1' ' ' LYS 1.492 72.1 tttt . . . . . 2 CA--C 1.889 13.982 1 CA-C-O 105.088 -7.148 . . . . 8.0 118.36 . . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . 0.879 78.4 t -98.72 126.85 51.78 Favored 'Isoleucine or valine' 2 C--N 1.636 13.037 2 CA-C-N 135.602 8.364 . . . . 8.0 98.956 168.465 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . 1.599 ' CG ' ' CD1' ' A' ' 3' ' ' PHE 0.654 20.6 m-85 -72.96 166.2 23.51 Favored 'General case' 4 C--O 0.844 -20.24 1 CA-C-N 102.61 -6.632 . . . . 8.0 106.798 164.63 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . 1.441 ' CA ' ' C ' ' A' ' 4' ' ' GLY . . . -111.07 158.97 14.03 Favored Glycine 4 CA--C 1.842 20.482 5 CA-C-O 89.371 -17.35 . . . . 8.0 100.117 -176.44 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . 1.378 ' CZ ' ' CD ' ' A' ' 5' ' ' ARG 0.67 26.7 ttp85 -56.42 -77.02 0.03 OUTLIER 'General case' 4 N--CA 1.165 -14.676 4 O-C-N 161.361 22.447 . . . . 8.0 92.533 -162.903 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . 1.5 ' N ' ' CA ' ' A' ' 6' ' ' CYS 0.272 0.9 OUTLIER -29.81 -46.5 0.06 Allowed 'General case' 4 CA--C 1.856 12.713 2 O-C-N 93.705 -18.122 . . . . 16.0 108.259 -170.876 -101.058 -34.876 -102.479 97.071 2.056 106.002 -41.804 -35.706 6 4 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . 1.577 ' CG ' ' CB ' ' A' ' 7' ' ' GLU 0.462 12.4 tt0 -81.05 -19.89 42.81 Favored 'General case' 3 C--N 1.55 9.321 2 O-C-N 95.4 -17.062 . . . . 8.0 114.142 -159.785 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . 1.582 ' CG ' ' CD2' ' A' ' 8' ' ' LEU 0.753 55.3 tp -49.61 -56.17 10.96 Favored 'General case' 3 CA--C 1.261 -10.141 3 C-N-CA 154.418 13.087 . . . . 8.0 109.419 157.218 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . 1.41 ' N ' ' C ' ' A' ' 8' ' ' LEU . . . -64.59 -58.53 6.11 Favored 'General case' 4 C--N 1.699 15.771 1 CA-C-O 129.957 4.694 . . . . 8.0 102.783 -162.722 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . 1.537 ' CB ' ' CA ' ' A' ' 10' ' ' ALA 0.534 . . -57.34 -35.18 69.59 Favored 'General case' 3 C--N 1.825 21.274 1 O-C-N 114.194 -5.316 . . . . 8.0 120.311 -177.957 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . 1.285 ' N ' ' O ' ' A' ' 10' ' ' ALA 0.518 . . -35.83 -67.47 0.16 Allowed 'General case' 3 C--N 0.738 -26.004 1 C-N-CA 134.991 5.316 . . . . 8.0 107.287 170.013 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . 0.878 ' CE ' ' CD1' ' A' ' 17' ' ' LEU . 92.9 mtp -69.52 -29.64 67.3 Favored 'General case' 3 C--O 1.61 20.074 2 O-C-N 138.888 10.118 . . . . 16.0 118.062 -178.603 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . 1.612 ' CB ' ' CA ' ' A' ' 13' ' ' LYS 0.819 48.8 tttt -42.04 -73.21 0.05 OUTLIER 'General case' 2 C--O 1.434 10.784 2 N-CA-C 142.0 11.481 . . . . 8.0 142.0 148.318 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 1.517 2.9 ptm180 -16.22 -56.52 0.01 OUTLIER 'General case' 3 C--O 1.529 15.766 3 CA-C-N 90.585 -12.098 . . . . 8.0 106.422 144.849 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.439 49.2 m80 -87.04 6.96 29.81 Favored 'General case' 3 C--O 0.932 -15.633 4 O-C-N 90.676 -20.015 . . . . 8.0 124.295 -173.778 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.66 -10.65 50.18 Favored Glycine 4 CA--C 1.695 11.313 2 O-C-N 105.325 -10.859 . . . . 8.0 119.081 -170.648 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . 0.878 ' CD1' ' CE ' ' A' ' 12' ' ' MET 0.647 21.3 mt -53.32 -53.07 56.38 Favored 'General case' 3 C--O 1.431 10.643 2 CA-C-O 103.759 -7.782 . . . . 8.0 101.258 -173.966 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . 0.284 67.2 t0 -74.37 138.03 43.14 Favored 'General case' 1 N--CA 1.356 -5.14 0 CA-C-N 125.897 3.953 . . . . 8.0 107.764 -147.178 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.79 74.1 m-80 59.08 -0.51 0.14 Allowed 'General case' 1 N--CA 1.351 -5.386 3 CA-C-O 89.64 -14.505 . . . . 8.0 124.587 -154.085 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . 1.59 ' CZ ' ' CE1' ' A' ' 20' ' ' TYR 0.561 29.1 t80 -78.95 137.38 37.58 Favored 'General case' 4 N--CA 1.175 -14.216 4 O-C-N 144.242 13.464 . . . . 8.0 123.106 -168.353 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 1.599 ' CB ' ' CA ' ' A' ' 21' ' ' ARG 0.276 9.9 mmt180 47.68 37.91 7.58 Favored 'General case' 3 N--CA 1.868 20.47 1 O-C-N 109.756 -8.09 . . . . 8.0 107.269 -149.869 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . 0.43 ' C ' ' CA ' ' A' ' 23' ' ' TYR . . . 62.86 29.0 72.76 Favored Glycine 4 CA--C 1.706 12.022 3 O-C-N 105.281 -10.887 . . . . 8.0 116.714 177.857 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . 1.429 ' N ' ' CA ' ' A' ' 23' ' ' TYR 0.551 75.1 m-85 -98.4 142.81 29.57 Favored 'General case' 4 N--CA 1.802 17.145 3 N-CA-C 83.399 -10.223 . . . . 8.0 83.399 171.604 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . 0.827 ' OG ' ' O ' ' A' ' 153' ' ' HOH 0.406 24.2 t -61.21 130.32 45.65 Favored 'General case' 3 N--CA 1.148 -15.564 3 CA-C-O 86.585 -15.96 . . . . 8.0 150.242 139.93 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . 0.468 0.2 OUTLIER -36.37 -26.71 0.01 OUTLIER 'General case' 2 C--O 1.391 8.521 5 O-C-N 140.096 10.873 . . . . 8.0 139.059 -168.361 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.81 -35.57 73.28 Favored Glycine 3 CA--C 1.258 -16.01 4 C-N-CA 158.971 17.462 . . . . 8.0 109.39 -172.088 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . 1.22 ' ND2' ' CG ' ' A' ' 27' ' ' ASN 0.467 1.1 m-80 -81.77 -50.89 8.72 Favored 'General case' 1 C--O 1.421 10.117 5 O-C-N 87.309 -21.113 . . . . 8.0 92.641 -159.365 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . 0.321 95.3 m95 -71.15 -36.55 72.1 Favored 'General case' 2 N--CA 1.319 -6.988 3 O-C-N 140.969 11.418 . . . . 8.0 115.391 -168.2 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 39.8 t -85.43 -49.84 15.12 Favored 'Isoleucine or valine' 1 C--N 1.229 -4.65 3 O-C-N 111.996 -6.69 . . . . 8.0 105.166 -176.423 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . 1.647 ' CB ' ' CA ' ' A' ' 30' ' ' CYS 0.323 28.2 t -74.77 -3.8 33.78 Favored 'General case' 2 CA--C 1.285 -9.217 1 O-C-N 107.3 -9.625 . . . . 16.0 114.347 171.839 172.491 -80.81 -106.6 105.862 2.419 97.485 -73.895 -59.877 5 3 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . 1.382 ' CB ' ' CA ' ' A' ' 31' ' ' ALA 1.132 . . -84.19 -45.27 13.11 Favored 'General case' 2 N--CA 1.224 -11.738 3 O-C-N 87.494 -22.004 . . . . 8.0 113.649 178.075 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . 1.062 ' C ' ' N ' ' A' ' 32' ' ' ALA 1.138 . . -120.92 -27.23 5.04 Favored 'General case' 4 CA--C 2.305 29.995 1 N-CA-C 64.026 -17.398 . . . . 8.0 64.026 -128.443 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . 0.714 ' N ' ' N ' ' A' ' 32' ' ' ALA 0.463 10.6 tptt -71.14 -60.78 2.05 Favored 'General case' 1 C--N 1.191 -6.315 2 CA-C-O 144.22 11.486 . . . . 8.0 107.737 -170.79 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . 0.712 ' C ' ' CA ' ' A' ' 35' ' ' GLU . 9.8 m-85 -57.48 -33.44 67.99 Favored 'General case' 2 N--CA 1.183 -13.8 1 O-C-N 101.553 -13.217 . . . . 8.0 115.013 173.006 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . 1.523 ' N ' ' CA ' ' A' ' 35' ' ' GLU 0.396 0.0 OUTLIER -75.75 -41.8 52.22 Favored 'General case' 2 N--CA 1.673 10.718 0 O-C-N 127.606 3.066 . . . . 8.0 115.362 174.465 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . 0.636 1.8 p -116.73 -26.33 7.02 Favored 'General case' 4 C--N 1.166 -7.377 2 C-N-CA 133.068 4.547 . . . . 8.0 121.7 -170.713 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . 0.727 3.0 t30 71.66 19.95 4.83 Favored 'General case' 2 CA--C 1.694 6.497 1 CA-C-O 109.628 -4.987 . . . . 8.0 115.855 -175.793 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . 1.537 ' CB ' ' CA ' ' A' ' 38' ' ' PHE 0.714 6.0 m-30 82.8 -3.98 1.32 Allowed 'General case' 3 C--O 1.03 -10.464 2 CA-C-O 131.393 5.378 . . . . 8.0 124.527 177.048 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . 1.536 ' CA ' ' CB ' ' A' ' 39' ' ' ASN 0.5 14.4 t-20 -102.89 106.65 17.26 Favored 'General case' 0 C--N 1.425 3.881 3 CA-C-N 91.919 -11.491 . . . . 8.0 121.131 170.21 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 1.386 ' CA ' ' C ' ' A' ' 40' ' ' THR . 24.9 p -63.58 -15.29 57.7 Favored 'General case' 3 CA--C 1.899 14.395 2 CA-C-N 97.37 -9.014 . . . . 8.0 114.34 179.033 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . 1.38 ' N ' ' CA ' ' A' ' 41' ' ' GLN . 30.5 mt-30 -85.37 -30.02 23.98 Favored 'General case' 3 N--CA 1.839 19.021 2 CA-C-O 150.11 14.291 . . . . 8.0 116.95 178.879 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . 0.588 ' C ' ' O ' ' A' ' 41' ' ' GLN 0.269 . . -56.53 135.87 54.4 Favored 'General case' 1 C--N 1.619 12.316 1 O-C-N 92.889 -18.632 . . . . 8.0 103.545 -167.23 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . 1.379 ' OG1' ' CB ' ' A' ' 43' ' ' THR 0.556 81.8 p -129.06 160.11 33.83 Favored 'General case' 3 C--O 0.894 -17.651 2 O-C-N 115.429 -4.545 . . . . 8.0 99.777 179.705 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . 1.099 ' O ' ' CA ' ' A' ' 44' ' ' ASN 0.978 2.7 m-80 -154.56 110.66 3.22 Favored 'General case' 3 C--O 0.696 -28.032 0 CA-C-O 114.035 -2.888 . . . . 8.0 111.191 -162.655 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 1.621 ' CB ' ' CA ' ' A' ' 45' ' ' ARG 0.603 5.5 ttt180 -109.6 139.15 44.96 Favored 'General case' 3 N--CA 1.271 -9.376 0 C-N-CA 113.337 -3.345 . . . . 8.0 110.705 -179.069 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . 1.519 ' C ' ' CA ' ' A' ' 46' ' ' ASN 0.75 18.2 m120 -98.36 -142.28 0.31 Allowed 'General case' 2 C--O 1.486 13.545 0 C-N-CA 112.914 -3.514 . . . . 8.0 103.487 -168.513 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . 0.816 ' C ' ' CA ' ' A' ' 48' ' ' ASP 0.338 0.3 OUTLIER -94.31 -19.92 20.24 Favored 'General case' 3 CA--C 1.715 7.309 3 O-C-N 94.526 -17.609 . . . . 8.0 117.599 169.252 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . 1.448 ' N ' ' CA ' ' A' ' 48' ' ' ASP 0.527 3.3 p-10 -92.64 35.44 1.03 Allowed 'General case' 2 N--CA 1.742 14.175 3 O-C-N 149.16 16.537 . . . . 8.0 119.831 -177.148 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . 0.467 ' CA ' ' O ' ' A' ' 214' ' ' HOH . . . 102.05 -81.55 0.42 Allowed Glycine 3 C--O 1.029 -12.714 1 N-CA-C 90.771 -8.932 . . . . 8.0 90.771 173.438 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . 1.51 ' C ' ' CA ' ' A' ' 50' ' ' SER 0.704 0.3 OUTLIER 9.91 105.36 0.0 OUTLIER 'General case' 3 C--O 1.497 14.112 2 CA-C-O 100.165 -9.493 . . . . 8.0 123.776 175.731 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . 1.637 ' CA ' ' CB ' ' A' ' 51' ' ' THR 0.405 54.3 m -115.43 162.26 17.4 Favored 'General case' 4 C--N 0.548 -34.247 2 O-C-N 130.466 4.854 . . . . 8.0 121.492 167.85 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 18.9 m-20 -140.16 103.11 4.53 Favored 'General case' 2 C--O 1.079 -7.869 2 O-C-N 106.503 -10.123 . . . . 8.0 107.456 -155.065 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 52.5 m-85 -90.92 144.4 25.72 Favored 'General case' 3 C--O 1.515 15.066 3 C-N-CA 140.385 7.474 . . . . 8.0 125.596 175.508 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . 0.457 ' C ' ' C ' ' A' ' 55' ' ' ILE . . . 90.9 174.3 44.06 Favored Glycine 0 CA--C 1.474 -2.529 5 O-C-N 96.042 -16.661 . . . . 8.0 101.75 146.257 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . 1.372 ' CA ' ' N ' ' A' ' 55' ' ' ILE 0.524 6.3 tp -50.27 -29.64 6.24 Favored 'Isoleucine or valine' 3 N--CA 1.84 19.041 3 N-CA-C 89.23 -8.063 . . . . 8.0 89.23 -175.912 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . 1.531 ' CG ' ' CD2' ' A' ' 56' ' ' LEU 0.253 2.3 tp -136.27 23.81 3.23 Favored 'General case' 2 C--O 1.014 -11.314 2 CA-C-N 144.844 12.566 . . . . 8.0 103.754 -145.418 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.848 11.7 mm-40 35.45 51.88 0.67 Allowed 'General case' 0 C--N 1.42 3.665 1 CA-C-O 103.756 -7.783 . . . . 8.0 115.144 -176.795 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . 0.594 ' CG2' ' CB ' ' A' ' 63' ' ' TRP 0.364 1.0 OUTLIER -66.31 132.96 31.66 Favored 'Isoleucine or valine' 2 CA--C 1.302 -8.595 1 O-C-N 136.113 8.383 . . . . 8.0 119.0 174.252 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . 0.785 ' C ' ' CA ' ' A' ' 60' ' ' SER . 26.1 t-20 -82.04 165.07 20.97 Favored 'General case' 2 C--O 0.872 -18.795 0 CA-C-N 124.117 3.144 . . . . 8.0 116.789 177.647 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . 1.48 ' N ' ' CA ' ' A' ' 60' ' ' SER 0.509 25.1 p -106.36 10.74 31.49 Favored 'General case' 2 N--CA 1.745 14.276 4 CA-C-N 104.836 -5.62 . . . . 8.0 122.188 176.045 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . 1.556 ' CG ' ' CB ' ' A' ' 61' ' ' ARG 0.378 38.1 ttt180 -76.84 -18.42 58.38 Favored 'General case' 1 C--O 1.02 -11.022 1 CA-C-O 111.596 -4.049 . . . . 8.0 118.179 155.877 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . 0.263 0.7 OUTLIER -136.24 -41.75 0.64 Allowed 'General case' 3 C--O 0.951 -14.649 1 CA-C-N 128.586 5.175 . . . . 8.0 108.753 -176.606 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . 1.545 ' CA ' ' CB ' ' A' ' 63' ' ' TRP 0.257 43.5 m95 -92.12 -39.84 11.37 Favored 'General case' 1 C--O 1.127 -5.377 3 O-C-N 108.152 -9.092 . . . . 8.0 118.326 -170.614 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . 1.504 ' CA ' ' C ' ' A' ' 64' ' ' CYS 0.503 2.5 p -145.05 147.19 32.32 Favored 'General case' 3 N--CA 1.145 -15.679 2 CA-C-N 134.148 7.704 . . . . 16.0 113.327 176.04 43.297 86.445 95.057 103.086 2.341 110.707 -24.35 -71.91 5 3 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . 0.826 ' N ' ' CA ' ' A' ' 64' ' ' CYS 0.526 37.9 t30 -94.61 152.32 18.61 Favored 'General case' 2 C--O 1.383 8.109 4 O-C-N 143.316 12.885 . . . . 8.0 113.382 -172.931 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . 0.492 23.5 p-10 -159.98 23.96 0.17 Allowed 'General case' 3 CA--C 1.283 -9.306 1 O-C-N 131.863 5.727 . . . . 8.0 103.137 -159.194 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . 1.383 ' C ' ' N ' ' A' ' 68' ' ' ARG . . . 89.24 -6.78 83.21 Favored Glycine 4 CA--C 1.082 -26.991 4 O-C-N 95.84 -16.787 . . . . 8.0 114.79 134.636 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . 1.63 ' CA ' ' CB ' ' A' ' 68' ' ' ARG 0.283 21.1 ptt180 -122.05 17.73 10.85 Favored 'General case' 3 C--N 1.764 18.602 3 O-C-N 101.579 -12.718 . . . . 8.0 120.986 171.859 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . 0.325 22.9 m -118.86 87.33 32.98 Favored Pre-proline 2 C--O 1.32 4.763 2 CA-C-O 104.534 -7.412 . . . . 8.0 103.634 -178.296 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . 0.41 6.2 Cg_exo -42.93 -23.84 0.38 Allowed 'Trans proline' 1 C--N 1.103 -12.381 2 O-C-N 138.263 9.033 . . . . 8.0 128.9 174.214 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.36 -8.6 66.5 Favored Glycine 3 CA--C 1.419 -5.909 1 CA-C-O 108.414 -6.77 . . . . 8.0 114.391 173.783 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . 1.504 ' CA ' ' C ' ' A' ' 72' ' ' SER 0.34 4.0 m -60.46 129.96 44.19 Favored 'General case' 3 CA--C 1.79 10.193 3 O-C-N 143.852 12.148 . . . . 8.0 127.57 -171.219 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . 1.491 ' CB ' ' CG ' ' A' ' 73' ' ' ARG 0.254 21.2 mtt180 -127.85 123.95 36.34 Favored 'General case' 2 N--CA 1.286 -8.649 3 CA-C-N 99.985 -7.825 . . . . 8.0 96.517 -173.97 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . 1.606 ' CB ' ' CA ' ' A' ' 74' ' ' ASN 0.599 0.2 OUTLIER -118.03 88.12 2.85 Favored 'General case' 4 CA--C 1.999 18.212 4 O-C-N 111.435 -7.04 . . . . 8.0 97.46 -159.49 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . 1.535 ' CA ' ' CB ' ' A' ' 75' ' ' LEU 0.562 3.4 mm? -64.23 -47.44 79.64 Favored 'General case' 3 N--CA 1.24 -10.935 4 CA-C-N 93.886 -10.597 . . . . 8.0 111.143 -175.272 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . 0.419 ' C ' ' C ' ' A' ' 77' ' ' ASN . 37.8 m -89.2 29.75 1.04 Allowed 'General case' 2 CA--C 1.637 4.297 3 O-C-N 94.158 -17.839 . . . . 16.0 112.469 166.841 -52.005 149.903 95.292 103.641 2.222 104.5 23.633 -166.432 4 3 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . 1.492 ' C ' ' CA ' ' A' ' 77' ' ' ASN 0.316 5.2 t-20 50.8 42.02 27.19 Favored 'General case' 4 N--CA 1.2 -12.926 3 C-N-CA 138.719 6.808 . . . . 8.0 97.717 148.072 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . 0.583 ' N ' ' CA ' ' A' ' 77' ' ' ASN 0.282 10.3 tp -134.49 145.62 55.89 Favored Pre-proline 1 C--N 1.151 -8.026 1 CA-C-O 130.635 5.017 . . . . 8.0 103.369 -178.249 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . 0.609 ' C ' ' CA ' ' A' ' 80' ' ' CYS . 9.3 Cg_endo -80.43 129.06 7.33 Favored 'Trans proline' 2 CA--C 1.638 5.714 4 O-C-N 98.334 -11.982 . . . . 8.0 104.596 177.213 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . 1.427 ' N ' ' CA ' ' A' ' 80' ' ' CYS 0.836 68.6 m -10.62 -67.99 0.0 OUTLIER 'General case' 2 N--CA 1.823 18.208 2 O-C-N 135.261 7.851 . . . . 16.0 111.317 173.916 -71.91 -24.35 95.057 110.707 2.341 103.086 86.445 43.297 5 3 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . 1.31 ' CB ' ' OG ' ' A' ' 81' ' ' SER 0.286 0.2 OUTLIER -39.91 -43.99 1.6 Allowed 'General case' 3 C--O 1.396 8.803 2 CA-C-N 101.156 -7.293 . . . . 8.0 122.82 178.502 . . . . . . . . 6 4 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -38.51 -50.98 1.59 Allowed 'General case' 3 C--O 1.497 14.122 0 O-C-N 127.731 3.144 . . . . 8.0 107.325 162.779 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . 0.424 ' N ' ' O ' ' A' ' 80' ' ' CYS 0.567 75.3 mt -43.51 -32.87 0.99 Allowed 'General case' 1 N--CA 1.36 -4.968 1 O-C-N 131.096 5.247 . . . . 8.0 120.276 -179.62 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . 1.589 ' CB ' ' CA ' ' A' ' 84' ' ' LEU 0.675 1.5 mt -96.67 -5.98 37.6 Favored 'General case' 3 C--O 1.049 -9.48 2 O-C-N 134.357 7.285 . . . . 8.0 116.768 -166.151 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . 1.385 ' C ' ' CA ' ' A' ' 85' ' ' SER 0.395 82.4 p -84.09 154.07 23.4 Favored 'General case' 2 CA--C 1.906 14.638 1 O-C-N 111.546 -6.971 . . . . 8.0 114.138 -179.035 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . 0.431 ' N ' ' CA ' ' A' ' 85' ' ' SER . 67.0 m -87.45 11.21 15.25 Favored 'General case' 3 C--O 0.984 -12.872 2 N-CA-C 95.839 -5.615 . . . . 8.0 95.839 -137.423 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.642 ' N ' ' C ' ' A' ' 85' ' ' SER 0.753 3.1 t70 -118.9 118.66 32.13 Favored 'General case' 1 CA--C 1.648 4.721 1 O-C-N 115.349 -4.594 . . . . 8.0 117.792 155.322 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . 0.711 11.1 pt -57.06 3.0 0.05 OUTLIER 'Isoleucine or valine' 2 C--O 1.529 15.769 2 CA-C-O 93.458 -12.687 . . . . 8.0 110.779 -175.982 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . 0.8 ' C ' ' CA ' ' A' ' 90' ' ' ALA 0.298 7.6 m -47.3 -73.63 0.04 OUTLIER 'General case' 2 C--O 0.882 -18.289 1 O-C-N 143.941 13.276 . . . . 8.0 112.154 -169.694 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . 1.496 ' N ' ' CA ' ' A' ' 90' ' ' ALA 1.279 . . -9.16 -78.47 0.0 OUTLIER 'General case' 3 C--O 0.897 -17.45 5 O-C-N 151.659 18.1 . . . . 8.0 123.628 158.863 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . 1.541 ' N ' ' CA ' ' A' ' 91' ' ' SER . 50.9 m -59.77 -59.51 5.32 Favored 'General case' 4 C--O 1.004 -11.825 1 CA-C-N 104.591 -5.731 . . . . 8.0 111.084 -169.875 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . 1.576 ' CB ' ' CG2' ' A' ' 92' ' ' VAL 0.482 2.1 t -57.62 -37.5 59.18 Favored 'Isoleucine or valine' 3 C--O 0.804 -22.356 0 CA-C-O 124.593 2.14 . . . . 8.0 111.267 -175.504 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . 0.891 ' N ' ' O ' ' A' ' 92' ' ' VAL 0.334 3.9 m-20 -76.39 -19.22 58.36 Favored 'General case' 3 N--CA 1.636 8.837 2 CA-C-N 104.938 -5.574 . . . . 8.0 106.862 -176.526 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . 0.253 14.1 t -79.09 -56.51 4.32 Favored 'General case' 2 N--CA 1.636 8.84 2 CA-C-O 133.545 6.402 . . . . 16.0 109.05 174.097 -166.432 23.633 95.292 104.5 2.222 103.641 149.903 -52.005 4 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . 0.314 . . -42.39 -52.56 4.55 Favored 'General case' 3 C--O 1.007 -11.68 0 CA-C-N 109.375 -3.557 . . . . 8.0 107.766 171.52 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . 0.311 19.1 mttt -43.88 -35.28 1.91 Allowed 'General case' 3 C--O 1.359 6.826 4 O-C-N 111.53 -6.981 . . . . 8.0 109.121 173.602 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 1.489 ' CD ' ' CE ' ' A' ' 97' ' ' LYS 0.455 12.2 mttt -86.25 -20.54 28.31 Favored 'General case' 3 C--O 1.493 13.882 4 CA-C-O 97.339 -10.838 . . . . 8.0 112.321 172.528 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . 1.558 ' CD1' ' CG1' ' A' ' 98' ' ' ILE . 45.4 mt -83.93 -31.97 8.33 Favored 'Isoleucine or valine' 3 C--O 0.785 -23.352 1 O-C-N 148.633 16.208 . . . . 8.0 119.617 174.895 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . 1.575 ' CA ' ' CB ' ' A' ' 99' ' ' VAL 0.587 9.5 p -85.11 -1.12 6.55 Favored 'Isoleucine or valine' 2 N--CA 1.236 -11.16 1 O-C-N 135.658 8.099 . . . . 8.0 109.796 -178.156 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . 1.533 ' N ' ' CA ' ' A' ' 100' ' ' SER 0.535 64.5 m -127.09 24.54 6.35 Favored 'General case' 3 N--CA 1.694 11.727 3 CA-C-O 103.18 -8.057 . . . . 8.0 96.983 -170.411 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . 1.18 ' OD1' ' O ' ' A' ' 228' ' ' HOH . 25.7 m-20 -111.15 -37.47 5.32 Favored 'General case' 4 N--CA 1.34 -5.942 1 N-CA-C 99.97 -4.085 . . . . 8.0 99.97 -171.097 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -172.88 -14.25 0.02 OUTLIER Glycine 2 C--O 1.065 -10.44 3 O-C-N 107.617 -9.427 . . . . 8.0 123.219 165.633 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . 0.52 ' O ' ' CB ' ' A' ' 106' ' ' ASN 0.354 44.5 m-80 -129.61 1.5 4.98 Favored 'General case' 1 C--O 1.113 -6.097 2 CA-C-O 130.449 4.928 . . . . 8.0 120.208 -151.464 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 50.31 -140.58 18.5 Favored Glycine 1 C--O 1.37 8.628 2 CA-C-N 99.344 -8.116 . . . . 8.0 111.523 -171.703 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.05 11.18 6.6 Favored 'General case' 0 C--O 1.292 3.317 2 O-C-N 138.514 9.008 . . . . 16.0 107.187 -171.995 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . 0.937 ' O ' ' NH2' ' A' ' 112' ' ' ARG . 6.7 m-20 -76.79 -34.79 57.95 Favored 'General case' 1 N--CA 1.615 7.814 1 O-C-N 115.54 -4.475 . . . . 8.0 102.854 -178.231 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . 1.566 ' CB ' ' CA ' ' A' ' 107' ' ' ALA 0.532 . . -45.07 -14.95 0.02 OUTLIER 'General case' 2 C--O 1.396 8.776 1 C-N-CA 138.798 6.839 . . . . 8.0 110.439 163.217 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . 0.534 3.4 m-90 -94.43 81.13 3.93 Favored 'General case' 3 C--N 1.153 -7.947 5 O-C-N 104.229 -11.544 . . . . 8.0 121.997 156.913 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . 0.47 ' CG1' ' N ' ' A' ' 110' ' ' ALA . 7.5 p -33.52 -48.3 0.11 Allowed 'Isoleucine or valine' 2 C--O 1.472 12.811 2 O-C-N 152.172 18.42 . . . . 8.0 110.7 178.832 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . 1.45 ' CB ' ' CA ' ' A' ' 110' ' ' ALA 0.385 . . -66.91 -47.67 71.03 Favored 'General case' 1 C--N 1.194 -6.169 0 CA-C-N 124.79 3.45 . . . . 8.0 119.576 178.653 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . 1.513 ' N ' ' CA ' ' A' ' 111' ' ' TRP 0.562 5.1 t90 -41.97 -55.76 3.03 Favored 'General case' 3 N--CA 1.673 10.71 3 O-C-N 106.616 -10.053 . . . . 8.0 106.928 171.878 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' A' ' 112' ' ' ARG . 40.3 ttm180 -56.38 -69.39 0.15 Allowed 'General case' 1 N--CA 1.62 8.028 2 CA-C-N 102.665 -6.607 . . . . 8.0 100.897 -172.923 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -64.25 -51.86 61.55 Favored 'General case' 2 CA--C 1.74 8.256 2 CA-C-N 129.068 5.395 . . . . 8.0 105.173 -166.046 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . 0.45 ' NE ' ' O ' ' A' ' 156' ' ' HOH . 4.7 mtp180 -100.74 -2.97 31.05 Favored 'General case' 2 C--O 1.038 -10.03 2 O-C-N 134.785 7.553 . . . . 8.0 119.213 -170.665 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . 1.179 ' SG ' ' SG ' ' A' ' 30' ' ' CYS 0.432 83.9 m -136.72 -36.5 0.69 Allowed 'General case' 2 C--O 1.002 -11.939 1 CA-C-O 129.324 4.392 . . . . 16.0 100.443 -166.465 -59.877 -73.895 -106.6 97.485 2.419 105.862 -80.81 172.491 5 3 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . 0.66 ' N ' ' O ' ' A' ' 111' ' ' TRP 0.346 32.6 tttt -63.87 110.95 2.26 Favored 'General case' 1 C--O 0.937 -15.388 1 O-C-N 105.678 -10.638 . . . . 8.0 112.433 -175.092 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.95 16.77 59.05 Favored Glycine 4 N--CA 1.261 -12.994 2 CA-C-O 106.807 -7.663 . . . . 8.0 116.77 -176.171 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.9 p -109.26 179.17 4.23 Favored 'General case' 1 C--O 1.087 -7.451 2 CA-C-N 129.697 6.749 . . . . 8.0 103.294 179.512 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . 1.442 ' CA ' ' C ' ' A' ' 119' ' ' ASP 0.397 13.6 p-10 -102.08 75.54 1.52 Allowed 'General case' 3 CA--C 1.808 10.871 0 O-C-N 117.407 -3.308 . . . . 8.0 102.913 -171.314 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . 0.57 ' N ' ' CA ' ' A' ' 119' ' ' ASP 0.355 16.4 m -60.35 -25.73 34.92 Favored 'Isoleucine or valine' 0 C--N 1.427 3.938 3 CA-C-O 103.083 -8.103 . . . . 8.0 95.427 -172.125 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . 0.68 ' CD ' ' O ' ' A' ' 143' ' ' HOH . 8.1 mt-30 -48.64 -24.79 1.47 Allowed 'General case' 2 C--O 0.866 -19.09 4 CA-C-N 141.339 10.972 . . . . 8.0 121.667 174.583 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . 1.547 ' CA ' ' C ' ' A' ' 122' ' ' ALA 0.412 . . -76.28 -15.77 59.93 Favored 'General case' 2 C--O 0.837 -20.624 2 O-C-N 138.173 9.671 . . . . 8.0 105.321 -172.89 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 0.917 ' O ' ' NH1' ' A' ' 5' ' ' ARG 0.617 84.3 m95 -65.31 -54.25 31.85 Favored 'General case' 3 C--O 1.534 16.074 1 CA-C-N 105.85 -5.159 . . . . 8.0 107.223 172.803 . . . . . . . . 5 3 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . 0.478 14.4 pt -88.98 -12.22 10.1 Favored 'Isoleucine or valine' 3 C--N 1.564 9.915 2 O-C-N 103.168 -12.208 . . . . 8.0 108.317 -167.738 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . 1.262 ' NH2' ' OD1' ' A' ' 119' ' ' ASP . 19.1 mtt180 -58.12 126.11 26.09 Favored 'General case' 3 C--O 0.871 -18.835 2 O-C-N 111.077 -7.265 . . . . 8.0 117.975 173.875 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 105.14 -13.77 48.55 Favored Glycine 3 C--O 0.872 -22.513 0 N-CA-C 104.611 -3.396 . . . . 8.0 104.611 173.737 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . 0.544 2.9 m -71.08 125.14 26.08 Favored 'General case' 0 CA--C 1.432 -3.558 1 N-CA-C 131.157 7.466 . . . . 16.0 131.157 171.251 -35.706 -41.804 -102.479 106.002 2.056 97.071 -34.876 -101.058 3 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . 0.531 5.4 mtt180 -68.74 99.14 0.98 Allowed 'General case' 2 C--N 1.072 -11.481 3 CA-C-O 105.817 -6.801 . . . . 8.0 105.03 175.052 . . . . . . . . 4 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . 1.526 ' CG ' ' CD2' ' A' ' 129' ' ' LEU . 60.0 mt . . . . . 2 C--O 0.874 -18.689 1 CA-C-N 129.235 5.47 . . . . 8.0 106.828 -177.36 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . 0.466 ' O ' ' CB ' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . 0.68 ' O ' ' CD ' ' A' ' 121' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . 0.827 ' O ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . 0.45 ' O ' ' NE ' ' A' ' 114' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . 0.415 ' O ' ' CB ' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 187' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 198' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . 1.006 ' O ' ' CD1' ' A' ' 63' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . 0.467 ' O ' ' CA ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . 0.632 ' O ' ' NE ' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . 0.596 ' O ' ' NH1' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.758 ' O ' ' CB ' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . 1.058 ' O ' ' CB ' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . 1.18 ' O ' ' OD1' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . 1.402 ' C ' ' CA ' ' A' ' 1' ' ' LYS 1.492 72.1 tttt . . . . . 2 CA--C 1.889 13.982 1 CA-C-O 105.088 -7.148 . . . . 8.0 118.36 . . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . 0.655 ' HA ' ' O ' ' A' ' 38' ' ' PHE 0.879 78.4 t -98.72 126.85 51.78 Favored 'Isoleucine or valine' 2 C--N 1.636 13.037 2 CA-C-N 135.602 8.364 . . . . 8.0 98.956 168.465 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . 1.599 ' CD1' ' CG ' ' A' ' 3' ' ' PHE 0.654 20.6 m-85 -72.96 166.2 23.51 Favored 'General case' 4 C--O 0.844 -20.24 1 CA-C-N 102.61 -6.632 . . . . 8.0 106.798 164.63 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . 1.441 ' C ' ' CA ' ' A' ' 4' ' ' GLY . . . -111.07 158.97 14.03 Favored Glycine 4 CA--C 1.842 20.482 5 CA-C-O 89.371 -17.35 . . . . 8.0 100.117 -176.44 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . 1.378 ' CZ ' ' CD ' ' A' ' 5' ' ' ARG 0.67 26.7 ttp85 -56.42 -77.02 0.03 OUTLIER 'General case' 4 N--CA 1.165 -14.676 4 O-C-N 161.361 22.447 . . . . 8.0 92.533 -162.903 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . 1.5 ' CA ' ' N ' ' A' ' 6' ' ' CYS 0.272 0.9 OUTLIER -29.81 -46.5 0.06 Allowed 'General case' 4 CA--C 1.856 12.713 2 O-C-N 93.705 -18.122 . . . . 16.0 108.259 -170.876 -101.058 -34.876 -102.479 97.071 2.056 106.002 -41.804 -35.706 6 4 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . 1.577 ' CG ' ' CB ' ' A' ' 7' ' ' GLU 0.462 12.4 tt0 -81.05 -19.89 42.81 Favored 'General case' 3 C--N 1.55 9.321 2 O-C-N 95.4 -17.062 . . . . 8.0 114.142 -159.785 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 1.582 ' CG ' ' CD2' ' A' ' 8' ' ' LEU 0.753 55.3 tp -49.61 -56.17 10.96 Favored 'General case' 3 CA--C 1.261 -10.141 3 C-N-CA 154.418 13.087 . . . . 8.0 109.419 157.218 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 1.41 ' N ' ' C ' ' A' ' 8' ' ' LEU . . . -64.59 -58.53 6.11 Favored 'General case' 4 C--N 1.699 15.771 1 CA-C-O 129.957 4.694 . . . . 8.0 102.783 -162.722 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . 1.537 ' CB ' ' CA ' ' A' ' 10' ' ' ALA 0.534 . . -57.34 -35.18 69.59 Favored 'General case' 3 C--N 1.825 21.274 1 O-C-N 114.194 -5.316 . . . . 8.0 120.311 -177.957 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . 1.285 ' N ' ' O ' ' A' ' 10' ' ' ALA 0.518 . . -35.83 -67.47 0.16 Allowed 'General case' 3 C--N 0.738 -26.004 1 C-N-CA 134.991 5.316 . . . . 8.0 107.287 170.013 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . 0.882 ' HE3' ' CD1' ' A' ' 17' ' ' LEU . 92.9 mtp -69.52 -29.64 67.3 Favored 'General case' 3 C--O 1.61 20.074 2 O-C-N 138.888 10.118 . . . . 16.0 118.062 -178.603 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . 1.612 ' CA ' ' CB ' ' A' ' 13' ' ' LYS 0.819 48.8 tttt -42.04 -73.21 0.05 OUTLIER 'General case' 2 C--O 1.434 10.784 2 N-CA-C 142.0 11.481 . . . . 8.0 142.0 148.318 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 14' ' ' ARG 1.517 2.9 ptm180 -16.22 -56.52 0.01 OUTLIER 'General case' 3 C--O 1.529 15.766 3 CA-C-N 90.585 -12.098 . . . . 8.0 106.422 144.849 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.581 ' HB3' HG11 ' A' ' 92' ' ' VAL 0.439 49.2 m80 -87.04 6.96 29.81 Favored 'General case' 3 C--O 0.932 -15.633 4 O-C-N 90.676 -20.015 . . . . 8.0 124.295 -173.778 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.66 -10.65 50.18 Favored Glycine 4 CA--C 1.695 11.313 2 O-C-N 105.325 -10.859 . . . . 8.0 119.081 -170.648 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.882 ' CD1' ' HE3' ' A' ' 12' ' ' MET 0.647 21.3 mt -53.32 -53.07 56.38 Favored 'General case' 3 C--O 1.431 10.643 2 CA-C-O 103.759 -7.782 . . . . 8.0 101.258 -173.966 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . 0.284 67.2 t0 -74.37 138.03 43.14 Favored 'General case' 1 N--CA 1.356 -5.14 0 CA-C-N 125.897 3.953 . . . . 8.0 107.764 -147.178 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.79 74.1 m-80 59.08 -0.51 0.14 Allowed 'General case' 1 N--CA 1.351 -5.386 3 CA-C-O 89.64 -14.505 . . . . 8.0 124.587 -154.085 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . 1.59 ' CZ ' ' CE1' ' A' ' 20' ' ' TYR 0.561 29.1 t80 -78.95 137.38 37.58 Favored 'General case' 4 N--CA 1.175 -14.216 4 O-C-N 144.242 13.464 . . . . 8.0 123.106 -168.353 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 1.599 ' CB ' ' CA ' ' A' ' 21' ' ' ARG 0.276 9.9 mmt180 47.68 37.91 7.58 Favored 'General case' 3 N--CA 1.868 20.47 1 O-C-N 109.756 -8.09 . . . . 8.0 107.269 -149.869 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . 0.43 ' C ' ' CA ' ' A' ' 23' ' ' TYR . . . 62.86 29.0 72.76 Favored Glycine 4 CA--C 1.706 12.022 3 O-C-N 105.281 -10.887 . . . . 8.0 116.714 177.857 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . 1.429 ' CA ' ' N ' ' A' ' 23' ' ' TYR 0.551 75.1 m-85 -98.4 142.81 29.57 Favored 'General case' 4 N--CA 1.802 17.145 3 N-CA-C 83.399 -10.223 . . . . 8.0 83.399 171.604 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . 0.825 ' HB3' HD22 ' A' ' 27' ' ' ASN 0.406 24.2 t -61.21 130.32 45.65 Favored 'General case' 3 N--CA 1.148 -15.564 3 CA-C-O 86.585 -15.96 . . . . 8.0 150.242 139.93 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.425 HD23 HG23 ' A' ' 29' ' ' VAL 0.468 0.2 OUTLIER -36.37 -26.71 0.01 OUTLIER 'General case' 2 C--O 1.391 8.521 5 O-C-N 140.096 10.873 . . . . 8.0 139.059 -168.361 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.81 -35.57 73.28 Favored Glycine 3 CA--C 1.258 -16.01 4 C-N-CA 158.971 17.462 . . . . 8.0 109.39 -172.088 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . 1.22 ' CG ' ' ND2' ' A' ' 27' ' ' ASN 0.467 1.1 m-80 -81.77 -50.89 8.72 Favored 'General case' 1 C--O 1.421 10.117 5 O-C-N 87.309 -21.113 . . . . 8.0 92.641 -159.365 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . 0.648 ' HB3' ' CE ' ' A' ' 12' ' ' MET 0.321 95.3 m95 -71.15 -36.55 72.1 Favored 'General case' 2 N--CA 1.319 -6.988 3 O-C-N 140.969 11.418 . . . . 8.0 115.391 -168.2 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG23 HD23 ' A' ' 25' ' ' LEU . 39.8 t -85.43 -49.84 15.12 Favored 'Isoleucine or valine' 1 C--N 1.229 -4.65 3 O-C-N 111.996 -6.69 . . . . 8.0 105.166 -176.423 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . 1.647 ' CA ' ' CB ' ' A' ' 30' ' ' CYS 0.323 28.2 t -74.77 -3.8 33.78 Favored 'General case' 2 CA--C 1.285 -9.217 1 O-C-N 107.3 -9.625 . . . . 16.0 114.347 171.839 172.491 -80.81 -106.6 105.862 2.419 97.485 -73.895 -59.877 5 3 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . 1.382 ' CB ' ' CA ' ' A' ' 31' ' ' ALA 1.132 . . -84.19 -45.27 13.11 Favored 'General case' 2 N--CA 1.224 -11.738 3 O-C-N 87.494 -22.004 . . . . 8.0 113.649 178.075 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . 1.062 ' C ' ' N ' ' A' ' 32' ' ' ALA 1.138 . . -120.92 -27.23 5.04 Favored 'General case' 4 CA--C 2.305 29.995 1 N-CA-C 64.026 -17.398 . . . . 8.0 64.026 -128.443 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.714 ' N ' ' N ' ' A' ' 32' ' ' ALA 0.463 10.6 tptt -71.14 -60.78 2.05 Favored 'General case' 1 C--N 1.191 -6.315 2 CA-C-O 144.22 11.486 . . . . 8.0 107.737 -170.79 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . 0.712 ' C ' ' CA ' ' A' ' 35' ' ' GLU . 9.8 m-85 -57.48 -33.44 67.99 Favored 'General case' 2 N--CA 1.183 -13.8 1 O-C-N 101.553 -13.217 . . . . 8.0 115.013 173.006 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . 1.523 ' CA ' ' N ' ' A' ' 35' ' ' GLU 0.396 0.0 OUTLIER -75.75 -41.8 52.22 Favored 'General case' 2 N--CA 1.673 10.718 0 O-C-N 127.606 3.066 . . . . 8.0 115.362 174.465 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . 0.701 ' OG ' ' HA ' ' A' ' 55' ' ' ILE 0.636 1.8 p -116.73 -26.33 7.02 Favored 'General case' 4 C--N 1.166 -7.377 2 C-N-CA 133.068 4.547 . . . . 8.0 121.7 -170.713 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . 0.588 ' C ' ' H ' ' A' ' 39' ' ' ASN 0.727 3.0 t30 71.66 19.95 4.83 Favored 'General case' 2 CA--C 1.694 6.497 1 CA-C-O 109.628 -4.987 . . . . 8.0 115.855 -175.793 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . 1.537 ' CB ' ' CA ' ' A' ' 38' ' ' PHE 0.714 6.0 m-30 82.8 -3.98 1.32 Allowed 'General case' 3 C--O 1.03 -10.464 2 CA-C-O 131.393 5.378 . . . . 8.0 124.527 177.048 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . 1.536 ' CB ' ' CA ' ' A' ' 39' ' ' ASN 0.5 14.4 t-20 -102.89 106.65 17.26 Favored 'General case' 0 C--N 1.425 3.881 3 CA-C-N 91.919 -11.491 . . . . 8.0 121.131 170.21 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 1.386 ' C ' ' CA ' ' A' ' 40' ' ' THR . 24.9 p -63.58 -15.29 57.7 Favored 'General case' 3 CA--C 1.899 14.395 2 CA-C-N 97.37 -9.014 . . . . 8.0 114.34 179.033 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . 1.38 ' CA ' ' N ' ' A' ' 41' ' ' GLN . 30.5 mt-30 -85.37 -30.02 23.98 Favored 'General case' 3 N--CA 1.839 19.021 2 CA-C-O 150.11 14.291 . . . . 8.0 116.95 178.879 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . 0.588 ' C ' ' O ' ' A' ' 41' ' ' GLN 0.269 . . -56.53 135.87 54.4 Favored 'General case' 1 C--N 1.619 12.316 1 O-C-N 92.889 -18.632 . . . . 8.0 103.545 -167.23 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . 1.379 ' OG1' ' CB ' ' A' ' 43' ' ' THR 0.556 81.8 p -129.06 160.11 33.83 Favored 'General case' 3 C--O 0.894 -17.651 2 O-C-N 115.429 -4.545 . . . . 8.0 99.777 179.705 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . 1.099 ' O ' ' CA ' ' A' ' 44' ' ' ASN 0.978 33.1 m120 -154.56 110.66 3.22 Favored 'General case' 3 C--O 0.696 -28.032 0 CA-C-O 114.035 -2.888 . . . . 8.0 111.191 -162.655 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 1.621 ' CA ' ' CB ' ' A' ' 45' ' ' ARG 0.603 5.5 ttt180 -109.6 139.15 44.96 Favored 'General case' 3 N--CA 1.271 -9.376 0 C-N-CA 113.337 -3.345 . . . . 8.0 110.705 -179.069 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . 1.519 ' CA ' ' C ' ' A' ' 46' ' ' ASN 0.75 3.1 m-80 -98.36 -142.28 0.31 Allowed 'General case' 2 C--O 1.486 13.545 0 C-N-CA 112.914 -3.514 . . . . 8.0 103.487 -168.513 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . 0.816 ' C ' ' CA ' ' A' ' 48' ' ' ASP 0.338 0.3 OUTLIER -94.31 -19.92 20.24 Favored 'General case' 3 CA--C 1.715 7.309 3 O-C-N 94.526 -17.609 . . . . 8.0 117.599 169.252 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . 1.448 ' CA ' ' N ' ' A' ' 48' ' ' ASP 0.527 3.3 p-10 -92.64 35.44 1.03 Allowed 'General case' 2 N--CA 1.742 14.175 3 O-C-N 149.16 16.537 . . . . 8.0 119.831 -177.148 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.467 ' CA ' ' O ' ' A' ' 214' ' ' HOH . . . 102.05 -81.55 0.42 Allowed Glycine 3 C--O 1.029 -12.714 1 N-CA-C 90.771 -8.932 . . . . 8.0 90.771 173.438 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . 1.51 ' C ' ' CA ' ' A' ' 50' ' ' SER 0.704 0.3 OUTLIER 9.91 105.36 0.0 OUTLIER 'General case' 3 C--O 1.497 14.112 2 CA-C-O 100.165 -9.493 . . . . 8.0 123.776 175.731 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . 1.637 ' CB ' ' CA ' ' A' ' 51' ' ' THR 0.405 54.3 m -115.43 162.26 17.4 Favored 'General case' 4 C--N 0.548 -34.247 2 O-C-N 130.466 4.854 . . . . 8.0 121.492 167.85 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.517 ' HB3' ' OE1' ' A' ' 57' ' ' GLN . 18.9 m-20 -140.16 103.11 4.53 Favored 'General case' 2 C--O 1.079 -7.869 2 O-C-N 106.503 -10.123 . . . . 8.0 107.456 -155.065 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' CE2' ' HB3' ' A' ' 80' ' ' CYS . 52.5 m-85 -90.92 144.4 25.72 Favored 'General case' 3 C--O 1.515 15.066 3 C-N-CA 140.385 7.474 . . . . 8.0 125.596 175.508 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . 0.457 ' C ' ' C ' ' A' ' 55' ' ' ILE . . . 90.9 174.3 44.06 Favored Glycine 0 CA--C 1.474 -2.529 5 O-C-N 96.042 -16.661 . . . . 8.0 101.75 146.257 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . 1.372 ' N ' ' CA ' ' A' ' 55' ' ' ILE 0.524 6.3 tp -50.27 -29.64 6.24 Favored 'Isoleucine or valine' 3 N--CA 1.84 19.041 3 N-CA-C 89.23 -8.063 . . . . 8.0 89.23 -175.912 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 1.531 ' CG ' ' CD2' ' A' ' 56' ' ' LEU 0.253 2.3 tp -136.27 23.81 3.23 Favored 'General case' 2 C--O 1.014 -11.314 2 CA-C-N 144.844 12.566 . . . . 8.0 103.754 -145.418 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . 0.517 ' OE1' ' HB3' ' A' ' 52' ' ' ASP 0.848 11.7 mm-40 35.45 51.88 0.67 Allowed 'General case' 0 C--N 1.42 3.665 1 CA-C-O 103.756 -7.783 . . . . 8.0 115.144 -176.795 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 63' ' ' TRP 0.364 1.0 OUTLIER -66.31 132.96 31.66 Favored 'Isoleucine or valine' 2 CA--C 1.302 -8.595 1 O-C-N 136.113 8.383 . . . . 8.0 119.0 174.252 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.785 ' C ' ' CA ' ' A' ' 60' ' ' SER . 26.1 t-20 -82.04 165.07 20.97 Favored 'General case' 2 C--O 0.872 -18.795 0 CA-C-N 124.117 3.144 . . . . 8.0 116.789 177.647 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . 1.48 ' N ' ' CA ' ' A' ' 60' ' ' SER 0.509 25.1 p -106.36 10.74 31.49 Favored 'General case' 2 N--CA 1.745 14.276 4 CA-C-N 104.836 -5.62 . . . . 8.0 122.188 176.045 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 1.556 ' CG ' ' CB ' ' A' ' 61' ' ' ARG 0.378 38.1 ttt180 -76.84 -18.42 58.38 Favored 'General case' 1 C--O 1.02 -11.022 1 CA-C-O 111.596 -4.049 . . . . 8.0 118.179 155.877 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . 0.481 ' HZ2' ' O ' ' A' ' 219' ' ' HOH 0.263 0.7 OUTLIER -136.24 -41.75 0.64 Allowed 'General case' 3 C--O 0.951 -14.649 1 CA-C-N 128.586 5.175 . . . . 8.0 108.753 -176.606 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 1.545 ' CB ' ' CA ' ' A' ' 63' ' ' TRP 0.257 43.5 m95 -92.12 -39.84 11.37 Favored 'General case' 1 C--O 1.127 -5.377 3 O-C-N 108.152 -9.092 . . . . 8.0 118.326 -170.614 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . 1.504 ' CA ' ' C ' ' A' ' 64' ' ' CYS 0.503 2.5 p -145.05 147.19 32.32 Favored 'General case' 3 N--CA 1.145 -15.679 2 CA-C-N 134.148 7.704 . . . . 16.0 113.327 176.04 43.297 86.445 95.057 103.086 2.341 110.707 -24.35 -71.91 5 3 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . 0.826 ' N ' ' CA ' ' A' ' 64' ' ' CYS 0.526 37.9 t30 -94.61 152.32 18.61 Favored 'General case' 2 C--O 1.383 8.109 4 O-C-N 143.316 12.885 . . . . 8.0 113.382 -172.931 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . 0.645 ' HB3' ' SG ' ' A' ' 80' ' ' CYS 0.492 23.5 p-10 -159.98 23.96 0.17 Allowed 'General case' 3 CA--C 1.283 -9.306 1 O-C-N 131.863 5.727 . . . . 8.0 103.137 -159.194 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 1.383 ' C ' ' N ' ' A' ' 68' ' ' ARG . . . 89.24 -6.78 83.21 Favored Glycine 4 CA--C 1.082 -26.991 4 O-C-N 95.84 -16.787 . . . . 8.0 114.79 134.636 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 1.63 ' CB ' ' CA ' ' A' ' 68' ' ' ARG 0.283 21.1 ptt180 -122.05 17.73 10.85 Favored 'General case' 3 C--N 1.764 18.602 3 O-C-N 101.579 -12.718 . . . . 8.0 120.986 171.859 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . 0.325 22.9 m -118.86 87.33 32.98 Favored Pre-proline 2 C--O 1.32 4.763 2 CA-C-O 104.534 -7.412 . . . . 8.0 103.634 -178.296 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.412 ' C ' ' H ' ' A' ' 72' ' ' SER 0.41 6.2 Cg_exo -42.93 -23.84 0.38 Allowed 'Trans proline' 1 C--N 1.103 -12.381 2 O-C-N 138.263 9.033 . . . . 8.0 128.9 174.214 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.36 -8.6 66.5 Favored Glycine 3 CA--C 1.419 -5.909 1 CA-C-O 108.414 -6.77 . . . . 8.0 114.391 173.783 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 1.504 ' C ' ' CA ' ' A' ' 72' ' ' SER 0.34 4.0 m -60.46 129.96 44.19 Favored 'General case' 3 CA--C 1.79 10.193 3 O-C-N 143.852 12.148 . . . . 8.0 127.57 -171.219 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . 1.491 ' CG ' ' CB ' ' A' ' 73' ' ' ARG 0.254 21.2 mtt180 -127.85 123.95 36.34 Favored 'General case' 2 N--CA 1.286 -8.649 3 CA-C-N 99.985 -7.825 . . . . 8.0 96.517 -173.97 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . 1.606 ' CB ' ' CA ' ' A' ' 74' ' ' ASN 0.599 35.4 t-20 -118.03 88.12 2.85 Favored 'General case' 4 CA--C 1.999 18.212 4 O-C-N 111.435 -7.04 . . . . 8.0 97.46 -159.49 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 1.535 ' CB ' ' CA ' ' A' ' 75' ' ' LEU 0.562 3.4 mm? -64.23 -47.44 79.64 Favored 'General case' 3 N--CA 1.24 -10.935 4 CA-C-N 93.886 -10.597 . . . . 8.0 111.143 -175.272 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . 0.419 ' C ' ' C ' ' A' ' 77' ' ' ASN . 37.8 m -89.2 29.75 1.04 Allowed 'General case' 2 CA--C 1.637 4.297 3 O-C-N 94.158 -17.839 . . . . 16.0 112.469 166.841 -52.005 149.903 95.292 103.641 2.222 104.5 23.633 -166.432 4 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . 1.492 ' C ' ' CA ' ' A' ' 77' ' ' ASN 0.316 5.2 t-20 50.8 42.02 27.19 Favored 'General case' 4 N--CA 1.2 -12.926 3 C-N-CA 138.719 6.808 . . . . 8.0 97.717 148.072 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . 0.583 ' N ' ' CA ' ' A' ' 77' ' ' ASN 0.282 10.3 tp -134.49 145.62 55.89 Favored Pre-proline 1 C--N 1.151 -8.026 1 CA-C-O 130.635 5.017 . . . . 8.0 103.369 -178.249 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . 0.614 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 9.3 Cg_endo -80.43 129.06 7.33 Favored 'Trans proline' 2 CA--C 1.638 5.714 4 O-C-N 98.334 -11.982 . . . . 8.0 104.596 177.213 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 1.427 ' N ' ' CA ' ' A' ' 80' ' ' CYS 0.836 68.6 m -10.62 -67.99 0.0 OUTLIER 'General case' 2 N--CA 1.823 18.208 2 O-C-N 135.261 7.851 . . . . 16.0 111.317 173.916 -71.91 -24.35 95.057 110.707 2.341 103.086 86.445 43.297 5 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . 1.31 ' OG ' ' CB ' ' A' ' 81' ' ' SER 0.286 0.2 OUTLIER -39.91 -43.99 1.6 Allowed 'General case' 3 C--O 1.396 8.803 2 CA-C-N 101.156 -7.293 . . . . 8.0 122.82 178.502 . . . . . . . . 6 4 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -38.51 -50.98 1.59 Allowed 'General case' 3 C--O 1.497 14.122 0 O-C-N 127.731 3.144 . . . . 8.0 107.325 162.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 80' ' ' CYS 0.567 75.3 mt -43.51 -32.87 0.99 Allowed 'General case' 1 N--CA 1.36 -4.968 1 O-C-N 131.096 5.247 . . . . 8.0 120.276 -179.62 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . 1.589 ' CB ' ' CA ' ' A' ' 84' ' ' LEU 0.675 1.5 mt -96.67 -5.98 37.6 Favored 'General case' 3 C--O 1.049 -9.48 2 O-C-N 134.357 7.285 . . . . 8.0 116.768 -166.151 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . 1.385 ' CA ' ' C ' ' A' ' 85' ' ' SER 0.395 82.4 p -84.09 154.07 23.4 Favored 'General case' 2 CA--C 1.906 14.638 1 O-C-N 111.546 -6.971 . . . . 8.0 114.138 -179.035 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . 0.431 ' N ' ' CA ' ' A' ' 85' ' ' SER . 67.0 m -87.45 11.21 15.25 Favored 'General case' 3 C--O 0.984 -12.872 2 N-CA-C 95.839 -5.615 . . . . 8.0 95.839 -137.423 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.642 ' N ' ' C ' ' A' ' 85' ' ' SER 0.753 3.1 t70 -118.9 118.66 32.13 Favored 'General case' 1 CA--C 1.648 4.721 1 O-C-N 115.349 -4.594 . . . . 8.0 117.792 155.322 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . 0.729 HD12 HG21 ' A' ' 92' ' ' VAL 0.711 11.1 pt -57.06 3.0 0.05 OUTLIER 'Isoleucine or valine' 2 C--O 1.529 15.769 2 CA-C-O 93.458 -12.687 . . . . 8.0 110.779 -175.982 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . 0.8 ' C ' ' CA ' ' A' ' 90' ' ' ALA 0.298 7.6 m -47.3 -73.63 0.04 OUTLIER 'General case' 2 C--O 0.882 -18.289 1 O-C-N 143.941 13.276 . . . . 8.0 112.154 -169.694 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . 1.496 ' N ' ' CA ' ' A' ' 90' ' ' ALA 1.279 . . -9.16 -78.47 0.0 OUTLIER 'General case' 3 C--O 0.897 -17.45 5 O-C-N 151.659 18.1 . . . . 8.0 123.628 158.863 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . 1.541 ' N ' ' CA ' ' A' ' 91' ' ' SER . 50.9 m -59.77 -59.51 5.32 Favored 'General case' 4 C--O 1.004 -11.825 1 CA-C-N 104.591 -5.731 . . . . 8.0 111.084 -169.875 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 1.576 ' CB ' ' CG2' ' A' ' 92' ' ' VAL 0.482 2.1 t -57.62 -37.5 59.18 Favored 'Isoleucine or valine' 3 C--O 0.804 -22.356 0 CA-C-O 124.593 2.14 . . . . 8.0 111.267 -175.504 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . 0.891 ' N ' ' O ' ' A' ' 92' ' ' VAL 0.334 3.9 m-20 -76.39 -19.22 58.36 Favored 'General case' 3 N--CA 1.636 8.837 2 CA-C-N 104.938 -5.574 . . . . 8.0 106.862 -176.526 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . 0.253 14.1 t -79.09 -56.51 4.32 Favored 'General case' 2 N--CA 1.636 8.84 2 CA-C-O 133.545 6.402 . . . . 16.0 109.05 174.097 -166.432 23.633 95.292 104.5 2.222 103.641 149.903 -52.005 4 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 92' ' ' VAL 0.314 . . -42.39 -52.56 4.55 Favored 'General case' 3 C--O 1.007 -11.68 0 CA-C-N 109.375 -3.557 . . . . 8.0 107.766 171.52 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . 0.468 ' O ' HG12 ' A' ' 99' ' ' VAL 0.311 19.1 mttt -43.88 -35.28 1.91 Allowed 'General case' 3 C--O 1.359 6.826 4 O-C-N 111.53 -6.981 . . . . 8.0 109.121 173.602 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . 1.489 ' CE ' ' CD ' ' A' ' 97' ' ' LYS 0.455 12.2 mttt -86.25 -20.54 28.31 Favored 'General case' 3 C--O 1.493 13.882 4 CA-C-O 97.339 -10.838 . . . . 8.0 112.321 172.528 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 1.558 ' CD1' ' CG1' ' A' ' 98' ' ' ILE . 45.4 mt -83.93 -31.97 8.33 Favored 'Isoleucine or valine' 3 C--O 0.785 -23.352 1 O-C-N 148.633 16.208 . . . . 8.0 119.617 174.895 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 1.575 ' CB ' ' CA ' ' A' ' 99' ' ' VAL 0.587 9.5 p -85.11 -1.12 6.55 Favored 'Isoleucine or valine' 2 N--CA 1.236 -11.16 1 O-C-N 135.658 8.099 . . . . 8.0 109.796 -178.156 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . 1.533 ' N ' ' CA ' ' A' ' 100' ' ' SER 0.535 64.5 m -127.09 24.54 6.35 Favored 'General case' 3 N--CA 1.694 11.727 3 CA-C-O 103.18 -8.057 . . . . 8.0 96.983 -170.411 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . 1.252 ' HB2' ' O ' ' A' ' 227' ' ' HOH . 25.7 m-20 -111.15 -37.47 5.32 Favored 'General case' 4 N--CA 1.34 -5.942 1 N-CA-C 99.97 -4.085 . . . . 8.0 99.97 -171.097 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -172.88 -14.25 0.02 OUTLIER Glycine 2 C--O 1.065 -10.44 3 O-C-N 107.617 -9.427 . . . . 8.0 123.219 165.633 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . 0.98 ' O ' ' HB2' ' A' ' 106' ' ' ASN 0.354 44.5 m-80 -129.61 1.5 4.98 Favored 'General case' 1 C--O 1.113 -6.097 2 CA-C-O 130.449 4.928 . . . . 8.0 120.208 -151.464 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 50.31 -140.58 18.5 Favored Glycine 1 C--O 1.37 8.628 2 CA-C-N 99.344 -8.116 . . . . 8.0 111.523 -171.703 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.05 11.18 6.6 Favored 'General case' 0 C--O 1.292 3.317 2 O-C-N 138.514 9.008 . . . . 16.0 107.187 -171.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . 0.98 ' HB2' ' O ' ' A' ' 103' ' ' ASN . 6.7 m-20 -76.79 -34.79 57.95 Favored 'General case' 1 N--CA 1.615 7.814 1 O-C-N 115.54 -4.475 . . . . 8.0 102.854 -178.231 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . 1.566 ' CA ' ' CB ' ' A' ' 107' ' ' ALA 0.532 . . -45.07 -14.95 0.02 OUTLIER 'General case' 2 C--O 1.396 8.776 1 C-N-CA 138.798 6.839 . . . . 8.0 110.439 163.217 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . 0.534 3.4 m-90 -94.43 81.13 3.93 Favored 'General case' 3 C--N 1.153 -7.947 5 O-C-N 104.229 -11.544 . . . . 8.0 121.997 156.913 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.617 HG13 ' N ' ' A' ' 110' ' ' ALA . 7.5 p -33.52 -48.3 0.11 Allowed 'Isoleucine or valine' 2 C--O 1.472 12.811 2 O-C-N 152.172 18.42 . . . . 8.0 110.7 178.832 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . 1.45 ' CB ' ' CA ' ' A' ' 110' ' ' ALA 0.385 . . -66.91 -47.67 71.03 Favored 'General case' 1 C--N 1.194 -6.169 0 CA-C-N 124.79 3.45 . . . . 8.0 119.576 178.653 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 1.513 ' N ' ' CA ' ' A' ' 111' ' ' TRP 0.562 5.1 t90 -41.97 -55.76 3.03 Favored 'General case' 3 N--CA 1.673 10.71 3 O-C-N 106.616 -10.053 . . . . 8.0 106.928 171.878 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' A' ' 112' ' ' ARG . 40.3 ttm180 -56.38 -69.39 0.15 Allowed 'General case' 1 N--CA 1.62 8.028 2 CA-C-N 102.665 -6.607 . . . . 8.0 100.897 -172.923 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -64.25 -51.86 61.55 Favored 'General case' 2 CA--C 1.74 8.256 2 CA-C-N 129.068 5.395 . . . . 8.0 105.173 -166.046 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -100.74 -2.97 31.05 Favored 'General case' 2 C--O 1.038 -10.03 2 O-C-N 134.785 7.553 . . . . 8.0 119.213 -170.665 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 30' ' ' CYS 0.432 83.9 m -136.72 -36.5 0.69 Allowed 'General case' 2 C--O 1.002 -11.939 1 CA-C-O 129.324 4.392 . . . . 16.0 100.443 -166.465 -59.877 -73.895 -106.6 97.485 2.419 105.862 -80.81 172.491 5 3 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . 0.66 ' N ' ' O ' ' A' ' 111' ' ' TRP 0.346 32.6 tttt -63.87 110.95 2.26 Favored 'General case' 1 C--O 0.937 -15.388 1 O-C-N 105.678 -10.638 . . . . 8.0 112.433 -175.092 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.95 16.77 59.05 Favored Glycine 4 N--CA 1.261 -12.994 2 CA-C-O 106.807 -7.663 . . . . 8.0 116.77 -176.171 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.9 p -109.26 179.17 4.23 Favored 'General case' 1 C--O 1.087 -7.451 2 CA-C-N 129.697 6.749 . . . . 8.0 103.294 179.512 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . 1.442 ' C ' ' CA ' ' A' ' 119' ' ' ASP 0.397 13.6 p-10 -102.08 75.54 1.52 Allowed 'General case' 3 CA--C 1.808 10.871 0 O-C-N 117.407 -3.308 . . . . 8.0 102.913 -171.314 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . 0.57 ' N ' ' CA ' ' A' ' 119' ' ' ASP 0.355 16.4 m -60.35 -25.73 34.92 Favored 'Isoleucine or valine' 0 C--N 1.427 3.938 3 CA-C-O 103.083 -8.103 . . . . 8.0 95.427 -172.125 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . 0.68 ' CD ' ' O ' ' A' ' 143' ' ' HOH . 8.1 mt-30 -48.64 -24.79 1.47 Allowed 'General case' 2 C--O 0.866 -19.09 4 CA-C-N 141.339 10.972 . . . . 8.0 121.667 174.583 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 1.547 ' CA ' ' C ' ' A' ' 122' ' ' ALA 0.412 . . -76.28 -15.77 59.93 Favored 'General case' 2 C--O 0.837 -20.624 2 O-C-N 138.173 9.671 . . . . 8.0 105.321 -172.89 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.914 ' O ' ' NH1' ' A' ' 5' ' ' ARG 0.617 84.3 m95 -65.31 -54.25 31.85 Favored 'General case' 3 C--O 1.534 16.074 1 CA-C-N 105.85 -5.159 . . . . 8.0 107.223 172.803 . . . . . . . . 5 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . 0.478 14.4 pt -88.98 -12.22 10.1 Favored 'Isoleucine or valine' 3 C--N 1.564 9.915 2 O-C-N 103.168 -12.208 . . . . 8.0 108.317 -167.738 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . 1.472 ' CD ' ' HA ' ' A' ' 122' ' ' ALA . 19.1 mtt180 -58.12 126.11 26.09 Favored 'General case' 3 C--O 0.871 -18.835 2 O-C-N 111.077 -7.265 . . . . 8.0 117.975 173.875 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 105.14 -13.77 48.55 Favored Glycine 3 C--O 0.872 -22.513 0 N-CA-C 104.611 -3.396 . . . . 8.0 104.611 173.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . 0.494 ' HB2' HD11 ' A' ' 129' ' ' LEU 0.544 2.9 m -71.08 125.14 26.08 Favored 'General case' 0 CA--C 1.432 -3.558 1 N-CA-C 131.157 7.466 . . . . 16.0 131.157 171.251 -35.706 -41.804 -102.479 106.002 2.056 97.071 -34.876 -101.058 4 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . 0.531 5.4 mtt180 -68.74 99.14 0.98 Allowed 'General case' 2 C--N 1.072 -11.481 3 CA-C-O 105.817 -6.801 . . . . 8.0 105.03 175.052 . . . . . . . . 4 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . 1.526 ' CG ' ' CD2' ' A' ' 129' ' ' LEU . 60.0 mt . . . . . 2 C--O 0.874 -18.689 1 CA-C-N 129.235 5.47 . . . . 8.0 106.828 -177.36 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . 0.899 ' O ' ' HB2' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . 0.68 ' O ' ' CD ' ' A' ' 121' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . 0.566 ' O ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . 0.644 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . 0.871 ' O ' ' HB3' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 187' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 198' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' HOH . . . . . 0.604 ' O ' HG12 ' A' ' 109' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.7 ' O ' ' HA ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . 1.006 ' O ' ' CD1' ' A' ' 63' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . 0.467 ' O ' ' CA ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . 0.632 ' O ' ' NE ' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . 0.481 ' O ' ' HZ2' ' A' ' 62' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . 0.924 ' O ' ' HB3' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . 1.252 ' O ' ' HB2' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . 1.18 ' O ' ' OD1' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . 1.402 ' C ' ' CA ' ' A' ' 1' ' ' LYS 1.492 72.1 tttt . . . . . 2 CA--C 1.889 13.982 1 CA-C-O 105.088 -7.148 . . . . 8.0 118.36 . . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.655 ' HA ' ' O ' ' A' ' 38' ' ' PHE 0.879 78.4 t -98.72 126.85 51.78 Favored 'Isoleucine or valine' 2 C--N 1.636 13.037 2 CA-C-N 135.602 8.364 . . . . 8.0 98.956 168.465 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . 1.599 ' CD1' ' CG ' ' A' ' 3' ' ' PHE 0.654 20.6 m-85 -72.96 166.2 23.51 Favored 'General case' 4 C--O 0.844 -20.24 1 CA-C-N 102.61 -6.632 . . . . 8.0 106.798 164.63 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . 1.441 ' C ' ' CA ' ' A' ' 4' ' ' GLY . . . -111.07 158.97 14.03 Favored Glycine 4 CA--C 1.842 20.482 5 CA-C-O 89.371 -17.35 . . . . 8.0 100.117 -176.44 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . 1.378 ' CZ ' ' CD ' ' A' ' 5' ' ' ARG 0.67 26.7 ttp85 -56.42 -77.02 0.03 OUTLIER 'General case' 4 N--CA 1.165 -14.676 4 O-C-N 161.361 22.447 . . . . 8.0 92.533 -162.903 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . 1.5 ' CA ' ' N ' ' A' ' 6' ' ' CYS 0.272 0.9 OUTLIER -29.81 -46.5 0.06 Allowed 'General case' 4 CA--C 1.856 12.713 2 O-C-N 93.705 -18.122 . . . . 16.0 108.259 -170.876 -101.058 -34.876 -102.479 97.071 2.056 106.002 -41.804 -35.706 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . 1.577 ' CG ' ' CB ' ' A' ' 7' ' ' GLU 0.462 12.4 tt0 -81.05 -19.89 42.81 Favored 'General case' 3 C--N 1.55 9.321 2 O-C-N 95.4 -17.062 . . . . 8.0 114.142 -159.785 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.582 ' CG ' ' CD2' ' A' ' 8' ' ' LEU 0.753 55.3 tp -49.61 -56.17 10.96 Favored 'General case' 3 CA--C 1.261 -10.141 3 C-N-CA 154.418 13.087 . . . . 8.0 109.419 157.218 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 1.41 ' N ' ' C ' ' A' ' 8' ' ' LEU . . . -64.59 -58.53 6.11 Favored 'General case' 4 C--N 1.699 15.771 1 CA-C-O 129.957 4.694 . . . . 8.0 102.783 -162.722 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . 1.537 ' CB ' ' CA ' ' A' ' 10' ' ' ALA 0.534 . . -57.34 -35.18 69.59 Favored 'General case' 3 C--N 1.825 21.274 1 O-C-N 114.194 -5.316 . . . . 8.0 120.311 -177.957 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . 1.285 ' N ' ' O ' ' A' ' 10' ' ' ALA 0.518 . . -35.83 -67.47 0.16 Allowed 'General case' 3 C--N 0.738 -26.004 1 C-N-CA 134.991 5.316 . . . . 8.0 107.287 170.013 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . 0.882 ' HE3' ' CD1' ' A' ' 17' ' ' LEU . 92.9 mtp -69.52 -29.64 67.3 Favored 'General case' 3 C--O 1.61 20.074 2 O-C-N 138.888 10.118 . . . . 16.0 118.062 -178.603 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . 1.612 ' CA ' ' CB ' ' A' ' 13' ' ' LYS 0.819 48.8 tttt -42.04 -73.21 0.05 OUTLIER 'General case' 2 C--O 1.434 10.784 2 N-CA-C 142.0 11.481 . . . . 8.0 142.0 148.318 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 14' ' ' ARG 1.517 2.9 ptm180 -16.22 -56.52 0.01 OUTLIER 'General case' 3 C--O 1.529 15.766 3 CA-C-N 90.585 -12.098 . . . . 8.0 106.422 144.849 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.581 ' HB3' HG11 ' A' ' 92' ' ' VAL 0.439 49.2 m80 -87.04 6.96 29.81 Favored 'General case' 3 C--O 0.932 -15.633 4 O-C-N 90.676 -20.015 . . . . 8.0 124.295 -173.778 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 81.66 -10.65 50.18 Favored Glycine 4 CA--C 1.695 11.313 2 O-C-N 105.325 -10.859 . . . . 8.0 119.081 -170.648 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.882 ' CD1' ' HE3' ' A' ' 12' ' ' MET 0.647 21.3 mt -53.32 -53.07 56.38 Favored 'General case' 3 C--O 1.431 10.643 2 CA-C-O 103.759 -7.782 . . . . 8.0 101.258 -173.966 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . 0.284 67.2 t0 -74.37 138.03 43.14 Favored 'General case' 1 N--CA 1.356 -5.14 0 CA-C-N 125.897 3.953 . . . . 8.0 107.764 -147.178 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . 0.79 74.1 m-80 59.08 -0.51 0.14 Allowed 'General case' 1 N--CA 1.351 -5.386 3 CA-C-O 89.64 -14.505 . . . . 8.0 124.587 -154.085 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.59 ' CZ ' ' CE1' ' A' ' 20' ' ' TYR 0.561 29.1 t80 -78.95 137.38 37.58 Favored 'General case' 4 N--CA 1.175 -14.216 4 O-C-N 144.242 13.464 . . . . 8.0 123.106 -168.353 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 1.599 ' CB ' ' CA ' ' A' ' 21' ' ' ARG 0.276 9.9 mmt180 47.68 37.91 7.58 Favored 'General case' 3 N--CA 1.868 20.47 1 O-C-N 109.756 -8.09 . . . . 8.0 107.269 -149.869 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.43 ' C ' ' CA ' ' A' ' 23' ' ' TYR . . . 62.86 29.0 72.76 Favored Glycine 4 CA--C 1.706 12.022 3 O-C-N 105.281 -10.887 . . . . 8.0 116.714 177.857 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . 1.429 ' CA ' ' N ' ' A' ' 23' ' ' TYR 0.551 75.1 m-85 -98.4 142.81 29.57 Favored 'General case' 4 N--CA 1.802 17.145 3 N-CA-C 83.399 -10.223 . . . . 8.0 83.399 171.604 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . 0.825 ' HB3' HD22 ' A' ' 27' ' ' ASN 0.406 24.2 t -61.21 130.32 45.65 Favored 'General case' 3 N--CA 1.148 -15.564 3 CA-C-O 86.585 -15.96 . . . . 8.0 150.242 139.93 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.425 HD23 HG23 ' A' ' 29' ' ' VAL 0.468 0.2 OUTLIER -36.37 -26.71 0.01 OUTLIER 'General case' 2 C--O 1.391 8.521 5 O-C-N 140.096 10.873 . . . . 8.0 139.059 -168.361 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -69.81 -35.57 73.28 Favored Glycine 3 CA--C 1.258 -16.01 4 C-N-CA 158.971 17.462 . . . . 8.0 109.39 -172.088 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . 1.22 ' CG ' ' ND2' ' A' ' 27' ' ' ASN 0.467 1.1 m-80 -81.77 -50.89 8.72 Favored 'General case' 1 C--O 1.421 10.117 5 O-C-N 87.309 -21.113 . . . . 8.0 92.641 -159.365 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . 0.648 ' HB3' ' CE ' ' A' ' 12' ' ' MET 0.321 95.3 m95 -71.15 -36.55 72.1 Favored 'General case' 2 N--CA 1.319 -6.988 3 O-C-N 140.969 11.418 . . . . 8.0 115.391 -168.2 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.425 HG23 HD23 ' A' ' 25' ' ' LEU . 39.8 t -85.43 -49.84 15.12 Favored 'Isoleucine or valine' 1 C--N 1.229 -4.65 3 O-C-N 111.996 -6.69 . . . . 8.0 105.166 -176.423 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . 1.647 ' CA ' ' CB ' ' A' ' 30' ' ' CYS 0.323 28.2 t -74.77 -3.8 33.78 Favored 'General case' 2 CA--C 1.285 -9.217 1 O-C-N 107.3 -9.625 . . . . 16.0 114.347 171.839 172.491 -80.81 -106.6 105.862 2.419 97.485 -73.895 -59.877 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . 1.382 ' CB ' ' CA ' ' A' ' 31' ' ' ALA 1.132 . . -84.19 -45.27 13.11 Favored 'General case' 2 N--CA 1.224 -11.738 3 O-C-N 87.494 -22.004 . . . . 8.0 113.649 178.075 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . 1.062 ' C ' ' N ' ' A' ' 32' ' ' ALA 1.138 . . -120.92 -27.23 5.04 Favored 'General case' 4 CA--C 2.305 29.995 1 N-CA-C 64.026 -17.398 . . . . 8.0 64.026 -128.443 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.714 ' N ' ' N ' ' A' ' 32' ' ' ALA 0.463 10.6 tptt -71.14 -60.78 2.05 Favored 'General case' 1 C--N 1.191 -6.315 2 CA-C-O 144.22 11.486 . . . . 8.0 107.737 -170.79 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.712 ' C ' ' CA ' ' A' ' 35' ' ' GLU . 9.8 m-85 -57.48 -33.44 67.99 Favored 'General case' 2 N--CA 1.183 -13.8 1 O-C-N 101.553 -13.217 . . . . 8.0 115.013 173.006 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . 1.523 ' CA ' ' N ' ' A' ' 35' ' ' GLU 0.396 0.0 OUTLIER -75.75 -41.8 52.22 Favored 'General case' 2 N--CA 1.673 10.718 0 O-C-N 127.606 3.066 . . . . 8.0 115.362 174.465 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . 0.701 ' OG ' ' HA ' ' A' ' 55' ' ' ILE 0.636 1.8 p -116.73 -26.33 7.02 Favored 'General case' 4 C--N 1.166 -7.377 2 C-N-CA 133.068 4.547 . . . . 8.0 121.7 -170.713 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . 0.588 ' C ' ' H ' ' A' ' 39' ' ' ASN 0.727 3.0 t30 71.66 19.95 4.83 Favored 'General case' 2 CA--C 1.694 6.497 1 CA-C-O 109.628 -4.987 . . . . 8.0 115.855 -175.793 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . 1.537 ' CB ' ' CA ' ' A' ' 38' ' ' PHE 0.714 6.0 m-30 82.8 -3.98 1.32 Allowed 'General case' 3 C--O 1.03 -10.464 2 CA-C-O 131.393 5.378 . . . . 8.0 124.527 177.048 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . 1.536 ' CB ' ' CA ' ' A' ' 39' ' ' ASN 0.5 14.4 t-20 -102.89 106.65 17.26 Favored 'General case' 0 C--N 1.425 3.881 3 CA-C-N 91.919 -11.491 . . . . 8.0 121.131 170.21 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 1.386 ' C ' ' CA ' ' A' ' 40' ' ' THR . 24.9 p -63.58 -15.29 57.7 Favored 'General case' 3 CA--C 1.899 14.395 2 CA-C-N 97.37 -9.014 . . . . 8.0 114.34 179.033 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 1.38 ' CA ' ' N ' ' A' ' 41' ' ' GLN . 30.5 mt-30 -85.37 -30.02 23.98 Favored 'General case' 3 N--CA 1.839 19.021 2 CA-C-O 150.11 14.291 . . . . 8.0 116.95 178.879 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.588 ' C ' ' O ' ' A' ' 41' ' ' GLN 0.269 . . -56.53 135.87 54.4 Favored 'General case' 1 C--N 1.619 12.316 1 O-C-N 92.889 -18.632 . . . . 8.0 103.545 -167.23 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . 1.379 ' OG1' ' CB ' ' A' ' 43' ' ' THR 0.556 81.8 p -129.06 160.11 33.83 Favored 'General case' 3 C--O 0.894 -17.651 2 O-C-N 115.429 -4.545 . . . . 8.0 99.777 179.705 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . 1.099 ' O ' ' CA ' ' A' ' 44' ' ' ASN 0.978 2.7 m-80 -154.56 110.66 3.22 Favored 'General case' 3 C--O 0.696 -28.032 0 CA-C-O 114.035 -2.888 . . . . 8.0 111.191 -162.655 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 1.621 ' CA ' ' CB ' ' A' ' 45' ' ' ARG 0.603 5.5 ttt180 -109.6 139.15 44.96 Favored 'General case' 3 N--CA 1.271 -9.376 0 C-N-CA 113.337 -3.345 . . . . 8.0 110.705 -179.069 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . 1.519 ' CA ' ' C ' ' A' ' 46' ' ' ASN 0.75 18.2 m120 -98.36 -142.28 0.31 Allowed 'General case' 2 C--O 1.486 13.545 0 C-N-CA 112.914 -3.514 . . . . 8.0 103.487 -168.513 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . 0.816 ' C ' ' CA ' ' A' ' 48' ' ' ASP 0.338 0.3 OUTLIER -94.31 -19.92 20.24 Favored 'General case' 3 CA--C 1.715 7.309 3 O-C-N 94.526 -17.609 . . . . 8.0 117.599 169.252 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . 1.448 ' CA ' ' N ' ' A' ' 48' ' ' ASP 0.527 3.3 p-10 -92.64 35.44 1.03 Allowed 'General case' 2 N--CA 1.742 14.175 3 O-C-N 149.16 16.537 . . . . 8.0 119.831 -177.148 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.467 ' CA ' ' O ' ' A' ' 214' ' ' HOH . . . 102.05 -81.55 0.42 Allowed Glycine 3 C--O 1.029 -12.714 1 N-CA-C 90.771 -8.932 . . . . 8.0 90.771 173.438 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . 1.51 ' C ' ' CA ' ' A' ' 50' ' ' SER 0.704 0.3 OUTLIER 9.91 105.36 0.0 OUTLIER 'General case' 3 C--O 1.497 14.112 2 CA-C-O 100.165 -9.493 . . . . 8.0 123.776 175.731 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . 1.637 ' CB ' ' CA ' ' A' ' 51' ' ' THR 0.405 54.3 m -115.43 162.26 17.4 Favored 'General case' 4 C--N 0.548 -34.247 2 O-C-N 130.466 4.854 . . . . 8.0 121.492 167.85 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.517 ' HB3' ' OE1' ' A' ' 57' ' ' GLN . 18.9 m-20 -140.16 103.11 4.53 Favored 'General case' 2 C--O 1.079 -7.869 2 O-C-N 106.503 -10.123 . . . . 8.0 107.456 -155.065 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.533 ' CE2' ' HB3' ' A' ' 80' ' ' CYS . 52.5 m-85 -90.92 144.4 25.72 Favored 'General case' 3 C--O 1.515 15.066 3 C-N-CA 140.385 7.474 . . . . 8.0 125.596 175.508 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.457 ' C ' ' C ' ' A' ' 55' ' ' ILE . . . 90.9 174.3 44.06 Favored Glycine 0 CA--C 1.474 -2.529 5 O-C-N 96.042 -16.661 . . . . 8.0 101.75 146.257 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . 1.372 ' N ' ' CA ' ' A' ' 55' ' ' ILE 0.524 6.3 tp -50.27 -29.64 6.24 Favored 'Isoleucine or valine' 3 N--CA 1.84 19.041 3 N-CA-C 89.23 -8.063 . . . . 8.0 89.23 -175.912 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 1.531 ' CG ' ' CD2' ' A' ' 56' ' ' LEU 0.253 2.3 tp -136.27 23.81 3.23 Favored 'General case' 2 C--O 1.014 -11.314 2 CA-C-N 144.844 12.566 . . . . 8.0 103.754 -145.418 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.517 ' OE1' ' HB3' ' A' ' 52' ' ' ASP 0.848 11.7 mm-40 35.45 51.88 0.67 Allowed 'General case' 0 C--N 1.42 3.665 1 CA-C-O 103.756 -7.783 . . . . 8.0 115.144 -176.795 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.829 HG22 ' HB2' ' A' ' 63' ' ' TRP 0.364 1.0 OUTLIER -66.31 132.96 31.66 Favored 'Isoleucine or valine' 2 CA--C 1.302 -8.595 1 O-C-N 136.113 8.383 . . . . 8.0 119.0 174.252 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.785 ' C ' ' CA ' ' A' ' 60' ' ' SER . 26.1 t-20 -82.04 165.07 20.97 Favored 'General case' 2 C--O 0.872 -18.795 0 CA-C-N 124.117 3.144 . . . . 8.0 116.789 177.647 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . 1.48 ' N ' ' CA ' ' A' ' 60' ' ' SER 0.509 25.1 p -106.36 10.74 31.49 Favored 'General case' 2 N--CA 1.745 14.276 4 CA-C-N 104.836 -5.62 . . . . 8.0 122.188 176.045 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 1.556 ' CG ' ' CB ' ' A' ' 61' ' ' ARG 0.378 38.1 ttt180 -76.84 -18.42 58.38 Favored 'General case' 1 C--O 1.02 -11.022 1 CA-C-O 111.596 -4.049 . . . . 8.0 118.179 155.877 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . 0.481 ' HZ2' ' O ' ' A' ' 219' ' ' HOH 0.263 0.7 OUTLIER -136.24 -41.75 0.64 Allowed 'General case' 3 C--O 0.951 -14.649 1 CA-C-N 128.586 5.175 . . . . 8.0 108.753 -176.606 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 1.545 ' CB ' ' CA ' ' A' ' 63' ' ' TRP 0.257 43.5 m95 -92.12 -39.84 11.37 Favored 'General case' 1 C--O 1.127 -5.377 3 O-C-N 108.152 -9.092 . . . . 8.0 118.326 -170.614 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . 1.504 ' CA ' ' C ' ' A' ' 64' ' ' CYS 0.503 2.5 p -145.05 147.19 32.32 Favored 'General case' 3 N--CA 1.145 -15.679 2 CA-C-N 134.148 7.704 . . . . 16.0 113.327 176.04 43.297 86.445 95.057 103.086 2.341 110.707 -24.35 -71.91 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.826 ' N ' ' CA ' ' A' ' 64' ' ' CYS 0.526 37.9 t30 -94.61 152.32 18.61 Favored 'General case' 2 C--O 1.383 8.109 4 O-C-N 143.316 12.885 . . . . 8.0 113.382 -172.931 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.645 ' HB3' ' SG ' ' A' ' 80' ' ' CYS 0.492 23.5 p-10 -159.98 23.96 0.17 Allowed 'General case' 3 CA--C 1.283 -9.306 1 O-C-N 131.863 5.727 . . . . 8.0 103.137 -159.194 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 1.383 ' C ' ' N ' ' A' ' 68' ' ' ARG . . . 89.24 -6.78 83.21 Favored Glycine 4 CA--C 1.082 -26.991 4 O-C-N 95.84 -16.787 . . . . 8.0 114.79 134.636 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 1.63 ' CB ' ' CA ' ' A' ' 68' ' ' ARG 0.283 21.1 ptt180 -122.05 17.73 10.85 Favored 'General case' 3 C--N 1.764 18.602 3 O-C-N 101.579 -12.718 . . . . 8.0 120.986 171.859 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . 0.325 22.9 m -118.86 87.33 32.98 Favored Pre-proline 2 C--O 1.32 4.763 2 CA-C-O 104.534 -7.412 . . . . 8.0 103.634 -178.296 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.412 ' C ' ' H ' ' A' ' 72' ' ' SER 0.41 6.2 Cg_exo -42.93 -23.84 0.38 Allowed 'Trans proline' 1 C--N 1.103 -12.381 2 O-C-N 138.263 9.033 . . . . 8.0 128.9 174.214 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -71.36 -8.6 66.5 Favored Glycine 3 CA--C 1.419 -5.909 1 CA-C-O 108.414 -6.77 . . . . 8.0 114.391 173.783 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 1.504 ' C ' ' CA ' ' A' ' 72' ' ' SER 0.34 4.0 m -60.46 129.96 44.19 Favored 'General case' 3 CA--C 1.79 10.193 3 O-C-N 143.852 12.148 . . . . 8.0 127.57 -171.219 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . 1.491 ' CG ' ' CB ' ' A' ' 73' ' ' ARG 0.254 21.2 mtt180 -127.85 123.95 36.34 Favored 'General case' 2 N--CA 1.286 -8.649 3 CA-C-N 99.985 -7.825 . . . . 8.0 96.517 -173.97 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . 1.606 ' CB ' ' CA ' ' A' ' 74' ' ' ASN 0.599 0.2 OUTLIER -118.03 88.12 2.85 Favored 'General case' 4 CA--C 1.999 18.212 4 O-C-N 111.435 -7.04 . . . . 8.0 97.46 -159.49 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 1.535 ' CB ' ' CA ' ' A' ' 75' ' ' LEU 0.562 3.4 mm? -64.23 -47.44 79.64 Favored 'General case' 3 N--CA 1.24 -10.935 4 CA-C-N 93.886 -10.597 . . . . 8.0 111.143 -175.272 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . 0.419 ' C ' ' C ' ' A' ' 77' ' ' ASN . 37.8 m -89.2 29.75 1.04 Allowed 'General case' 2 CA--C 1.637 4.297 3 O-C-N 94.158 -17.839 . . . . 16.0 112.469 166.841 -52.005 149.903 95.292 103.641 2.222 104.5 23.633 -166.432 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . 1.492 ' C ' ' CA ' ' A' ' 77' ' ' ASN 0.316 5.2 t-20 50.8 42.02 27.19 Favored 'General case' 4 N--CA 1.2 -12.926 3 C-N-CA 138.719 6.808 . . . . 8.0 97.717 148.072 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . 0.583 ' N ' ' CA ' ' A' ' 77' ' ' ASN 0.282 10.3 tp -134.49 145.62 55.89 Favored Pre-proline 1 C--N 1.151 -8.026 1 CA-C-O 130.635 5.017 . . . . 8.0 103.369 -178.249 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.614 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 9.3 Cg_endo -80.43 129.06 7.33 Favored 'Trans proline' 2 CA--C 1.638 5.714 4 O-C-N 98.334 -11.982 . . . . 8.0 104.596 177.213 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 1.427 ' N ' ' CA ' ' A' ' 80' ' ' CYS 0.836 68.6 m -10.62 -67.99 0.0 OUTLIER 'General case' 2 N--CA 1.823 18.208 2 O-C-N 135.261 7.851 . . . . 16.0 111.317 173.916 -71.91 -24.35 95.057 110.707 2.341 103.086 86.445 43.297 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . 1.31 ' OG ' ' CB ' ' A' ' 81' ' ' SER 0.286 0.2 OUTLIER -39.91 -43.99 1.6 Allowed 'General case' 3 C--O 1.396 8.803 2 CA-C-N 101.156 -7.293 . . . . 8.0 122.82 178.502 . . . . . . . . 6 4 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -38.51 -50.98 1.59 Allowed 'General case' 3 C--O 1.497 14.122 0 O-C-N 127.731 3.144 . . . . 8.0 107.325 162.779 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.529 ' HB2' ' O ' ' A' ' 80' ' ' CYS 0.567 75.3 mt -43.51 -32.87 0.99 Allowed 'General case' 1 N--CA 1.36 -4.968 1 O-C-N 131.096 5.247 . . . . 8.0 120.276 -179.62 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . 1.589 ' CB ' ' CA ' ' A' ' 84' ' ' LEU 0.675 1.5 mt -96.67 -5.98 37.6 Favored 'General case' 3 C--O 1.049 -9.48 2 O-C-N 134.357 7.285 . . . . 8.0 116.768 -166.151 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . 1.385 ' CA ' ' C ' ' A' ' 85' ' ' SER 0.395 82.4 p -84.09 154.07 23.4 Favored 'General case' 2 CA--C 1.906 14.638 1 O-C-N 111.546 -6.971 . . . . 8.0 114.138 -179.035 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . 0.431 ' N ' ' CA ' ' A' ' 85' ' ' SER . 67.0 m -87.45 11.21 15.25 Favored 'General case' 3 C--O 0.984 -12.872 2 N-CA-C 95.839 -5.615 . . . . 8.0 95.839 -137.423 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.642 ' N ' ' C ' ' A' ' 85' ' ' SER 0.753 3.1 t70 -118.9 118.66 32.13 Favored 'General case' 1 CA--C 1.648 4.721 1 O-C-N 115.349 -4.594 . . . . 8.0 117.792 155.322 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.729 HD12 HG21 ' A' ' 92' ' ' VAL 0.711 11.1 pt -57.06 3.0 0.05 OUTLIER 'Isoleucine or valine' 2 C--O 1.529 15.769 2 CA-C-O 93.458 -12.687 . . . . 8.0 110.779 -175.982 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . 0.8 ' C ' ' CA ' ' A' ' 90' ' ' ALA 0.298 7.6 m -47.3 -73.63 0.04 OUTLIER 'General case' 2 C--O 0.882 -18.289 1 O-C-N 143.941 13.276 . . . . 8.0 112.154 -169.694 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . 1.496 ' N ' ' CA ' ' A' ' 90' ' ' ALA 1.279 . . -9.16 -78.47 0.0 OUTLIER 'General case' 3 C--O 0.897 -17.45 5 O-C-N 151.659 18.1 . . . . 8.0 123.628 158.863 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . 1.541 ' N ' ' CA ' ' A' ' 91' ' ' SER . 50.9 m -59.77 -59.51 5.32 Favored 'General case' 4 C--O 1.004 -11.825 1 CA-C-N 104.591 -5.731 . . . . 8.0 111.084 -169.875 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 1.576 ' CB ' ' CG2' ' A' ' 92' ' ' VAL 0.482 2.1 t -57.62 -37.5 59.18 Favored 'Isoleucine or valine' 3 C--O 0.804 -22.356 0 CA-C-O 124.593 2.14 . . . . 8.0 111.267 -175.504 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.891 ' N ' ' O ' ' A' ' 92' ' ' VAL 0.334 3.9 m-20 -76.39 -19.22 58.36 Favored 'General case' 3 N--CA 1.636 8.837 2 CA-C-N 104.938 -5.574 . . . . 8.0 106.862 -176.526 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . 0.253 14.1 t -79.09 -56.51 4.32 Favored 'General case' 2 N--CA 1.636 8.84 2 CA-C-O 133.545 6.402 . . . . 16.0 109.05 174.097 -166.432 23.633 95.292 104.5 2.222 103.641 149.903 -52.005 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 92' ' ' VAL 0.314 . . -42.39 -52.56 4.55 Favored 'General case' 3 C--O 1.007 -11.68 0 CA-C-N 109.375 -3.557 . . . . 8.0 107.766 171.52 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.468 ' O ' HG12 ' A' ' 99' ' ' VAL 0.311 19.1 mttt -43.88 -35.28 1.91 Allowed 'General case' 3 C--O 1.359 6.826 4 O-C-N 111.53 -6.981 . . . . 8.0 109.121 173.602 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . 1.489 ' CE ' ' CD ' ' A' ' 97' ' ' LYS 0.455 12.2 mttt -86.25 -20.54 28.31 Favored 'General case' 3 C--O 1.493 13.882 4 CA-C-O 97.339 -10.838 . . . . 8.0 112.321 172.528 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 1.558 ' CD1' ' CG1' ' A' ' 98' ' ' ILE . 45.4 mt -83.93 -31.97 8.33 Favored 'Isoleucine or valine' 3 C--O 0.785 -23.352 1 O-C-N 148.633 16.208 . . . . 8.0 119.617 174.895 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 1.575 ' CB ' ' CA ' ' A' ' 99' ' ' VAL 0.587 9.5 p -85.11 -1.12 6.55 Favored 'Isoleucine or valine' 2 N--CA 1.236 -11.16 1 O-C-N 135.658 8.099 . . . . 8.0 109.796 -178.156 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . 1.533 ' N ' ' CA ' ' A' ' 100' ' ' SER 0.535 64.5 m -127.09 24.54 6.35 Favored 'General case' 3 N--CA 1.694 11.727 3 CA-C-O 103.18 -8.057 . . . . 8.0 96.983 -170.411 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . 1.252 ' HB2' ' O ' ' A' ' 227' ' ' HOH . 25.7 m-20 -111.15 -37.47 5.32 Favored 'General case' 4 N--CA 1.34 -5.942 1 N-CA-C 99.97 -4.085 . . . . 8.0 99.97 -171.097 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -172.88 -14.25 0.02 OUTLIER Glycine 2 C--O 1.065 -10.44 3 O-C-N 107.617 -9.427 . . . . 8.0 123.219 165.633 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.98 ' O ' ' HB2' ' A' ' 106' ' ' ASN 0.354 44.5 m-80 -129.61 1.5 4.98 Favored 'General case' 1 C--O 1.113 -6.097 2 CA-C-O 130.449 4.928 . . . . 8.0 120.208 -151.464 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 50.31 -140.58 18.5 Favored Glycine 1 C--O 1.37 8.628 2 CA-C-N 99.344 -8.116 . . . . 8.0 111.523 -171.703 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.05 11.18 6.6 Favored 'General case' 0 C--O 1.292 3.317 2 O-C-N 138.514 9.008 . . . . 16.0 107.187 -171.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . 0.98 ' HB2' ' O ' ' A' ' 103' ' ' ASN . 6.7 m-20 -76.79 -34.79 57.95 Favored 'General case' 1 N--CA 1.615 7.814 1 O-C-N 115.54 -4.475 . . . . 8.0 102.854 -178.231 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . 1.566 ' CA ' ' CB ' ' A' ' 107' ' ' ALA 0.532 . . -45.07 -14.95 0.02 OUTLIER 'General case' 2 C--O 1.396 8.776 1 C-N-CA 138.798 6.839 . . . . 8.0 110.439 163.217 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . 0.534 3.4 m-90 -94.43 81.13 3.93 Favored 'General case' 3 C--N 1.153 -7.947 5 O-C-N 104.229 -11.544 . . . . 8.0 121.997 156.913 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.617 HG13 ' N ' ' A' ' 110' ' ' ALA . 7.5 p -33.52 -48.3 0.11 Allowed 'Isoleucine or valine' 2 C--O 1.472 12.811 2 O-C-N 152.172 18.42 . . . . 8.0 110.7 178.832 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . 1.45 ' CB ' ' CA ' ' A' ' 110' ' ' ALA 0.385 . . -66.91 -47.67 71.03 Favored 'General case' 1 C--N 1.194 -6.169 0 CA-C-N 124.79 3.45 . . . . 8.0 119.576 178.653 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 1.513 ' N ' ' CA ' ' A' ' 111' ' ' TRP 0.562 5.1 t90 -41.97 -55.76 3.03 Favored 'General case' 3 N--CA 1.673 10.71 3 O-C-N 106.616 -10.053 . . . . 8.0 106.928 171.878 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . 1.589 ' CB ' ' CG ' ' A' ' 112' ' ' ARG . 40.3 ttm180 -56.38 -69.39 0.15 Allowed 'General case' 1 N--CA 1.62 8.028 2 CA-C-N 102.665 -6.607 . . . . 8.0 100.897 -172.923 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 -64.25 -51.86 61.55 Favored 'General case' 2 CA--C 1.74 8.256 2 CA-C-N 129.068 5.395 . . . . 8.0 105.173 -166.046 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 4.7 mtp180 -100.74 -2.97 31.05 Favored 'General case' 2 C--O 1.038 -10.03 2 O-C-N 134.785 7.553 . . . . 8.0 119.213 -170.665 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.762 ' SG ' ' SG ' ' A' ' 30' ' ' CYS 0.432 83.9 m -136.72 -36.5 0.69 Allowed 'General case' 2 C--O 1.002 -11.939 1 CA-C-O 129.324 4.392 . . . . 16.0 100.443 -166.465 -59.877 -73.895 -106.6 97.485 2.419 105.862 -80.81 172.491 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . 0.66 ' N ' ' O ' ' A' ' 111' ' ' TRP 0.346 32.6 tttt -63.87 110.95 2.26 Favored 'General case' 1 C--O 0.937 -15.388 1 O-C-N 105.678 -10.638 . . . . 8.0 112.433 -175.092 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.95 16.77 59.05 Favored Glycine 4 N--CA 1.261 -12.994 2 CA-C-O 106.807 -7.663 . . . . 8.0 116.77 -176.171 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 33.9 p -109.26 179.17 4.23 Favored 'General case' 1 C--O 1.087 -7.451 2 CA-C-N 129.697 6.749 . . . . 8.0 103.294 179.512 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . 1.442 ' C ' ' CA ' ' A' ' 119' ' ' ASP 0.397 13.6 p-10 -102.08 75.54 1.52 Allowed 'General case' 3 CA--C 1.808 10.871 0 O-C-N 117.407 -3.308 . . . . 8.0 102.913 -171.314 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.57 ' N ' ' CA ' ' A' ' 119' ' ' ASP 0.355 16.4 m -60.35 -25.73 34.92 Favored 'Isoleucine or valine' 0 C--N 1.427 3.938 3 CA-C-O 103.083 -8.103 . . . . 8.0 95.427 -172.125 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.68 ' CD ' ' O ' ' A' ' 143' ' ' HOH . 8.1 mt-30 -48.64 -24.79 1.47 Allowed 'General case' 2 C--O 0.866 -19.09 4 CA-C-N 141.339 10.972 . . . . 8.0 121.667 174.583 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 1.547 ' CA ' ' C ' ' A' ' 122' ' ' ALA 0.412 . . -76.28 -15.77 59.93 Favored 'General case' 2 C--O 0.837 -20.624 2 O-C-N 138.173 9.671 . . . . 8.0 105.321 -172.89 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.914 ' O ' ' NH1' ' A' ' 5' ' ' ARG 0.617 84.3 m95 -65.31 -54.25 31.85 Favored 'General case' 3 C--O 1.534 16.074 1 CA-C-N 105.85 -5.159 . . . . 8.0 107.223 172.803 . . . . . . . . 5 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . 0.478 14.4 pt -88.98 -12.22 10.1 Favored 'Isoleucine or valine' 3 C--N 1.564 9.915 2 O-C-N 103.168 -12.208 . . . . 8.0 108.317 -167.738 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . 1.472 ' CD ' ' HA ' ' A' ' 122' ' ' ALA . 19.1 mtt180 -58.12 126.11 26.09 Favored 'General case' 3 C--O 0.871 -18.835 2 O-C-N 111.077 -7.265 . . . . 8.0 117.975 173.875 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 105.14 -13.77 48.55 Favored Glycine 3 C--O 0.872 -22.513 0 N-CA-C 104.611 -3.396 . . . . 8.0 104.611 173.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.494 ' HB2' HD11 ' A' ' 129' ' ' LEU 0.544 2.9 m -71.08 125.14 26.08 Favored 'General case' 0 CA--C 1.432 -3.558 1 N-CA-C 131.157 7.466 . . . . 16.0 131.157 171.251 -35.706 -41.804 -102.479 106.002 2.056 97.071 -34.876 -101.058 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . 0.531 5.4 mtt180 -68.74 99.14 0.98 Allowed 'General case' 2 C--N 1.072 -11.481 3 CA-C-O 105.817 -6.801 . . . . 8.0 105.03 175.052 . . . . . . . . 4 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . 1.526 ' CG ' ' CD2' ' A' ' 129' ' ' LEU . 60.0 mt . . . . . 2 C--O 0.874 -18.689 1 CA-C-N 129.235 5.47 . . . . 8.0 106.828 -177.36 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . 0.899 ' O ' ' HB2' ' A' ' 6' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . 0.68 ' O ' ' CD ' ' A' ' 121' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . 0.566 ' O ' ' OG ' ' A' ' 24' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . 0.644 ' O ' ' HB2' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . 0.871 ' O ' ' HB3' ' A' ' 85' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 187' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 193' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 194' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 195' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 196' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 197' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 198' A HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 199' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' HOH . . . . . 0.604 ' O ' HG12 ' A' ' 109' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.7 ' O ' ' HA ' ' A' ' 47' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . 1.006 ' O ' ' CD1' ' A' ' 63' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . 0.467 ' O ' ' CA ' ' A' ' 49' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . 0.632 ' O ' ' NE ' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . 0.481 ' O ' ' HZ2' ' A' ' 62' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . 0.924 ' O ' ' HB3' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . 1.252 ' O ' ' HB2' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . 1.18 ' O ' ' OD1' ' A' ' 101' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_