data_6d02_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6d02 _Structure_validation_residue.Date_analyzed 2019-02-15 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' ' ' SER . . . . . 0.547 ' N ' ' O ' ' A' ' 101' ' ' HOH . 1.0 OUTLIER . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.871 0.367 . . . . 63.299999999999997 110.548 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.01 -39.65 56.29 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.029 -0.987 . . . . 76.200000000000003 111.159 -174.527 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -42.21 -48.77 4.94 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.396 0.887 . . . . 99.579999999999998 113.396 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 24.0 mt -118.2 -20.41 8.61 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 114.329 1.233 . . . . 73.730000000000004 114.329 -167.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . . . -48.24 -46.04 35.04 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 118.587 -1.245 . . . . 63.5 108.779 153.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.57 -49.36 62.23 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.449 -0.796 . . . . 57.969999999999999 111.309 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 8' ' ' ARG . 0.2 OUTLIER -75.12 -39.5 60.54 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 118.312 -1.355 . . . . 79.420000000000002 113.63 -177.434 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . 0.531 ' NH2' ' O2 ' ' A' ' 101' ' ' MPD . 4.4 ttt-85 -47.46 -49.93 24.28 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 117.669 -1.612 . . . . 219.37 109.411 176.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -65.86 -46.21 79.3 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.634 -0.826 . . . . 329.97000000000003 111.626 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 26.5 tp -59.68 -48.01 83.35 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.731 -0.787 . . . . 213.71000000000001 111.12 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 14' ' ' LEU . 3.8 mt -60.46 -39.64 88.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.236 -0.585 . . . . 71.540000000000006 111.683 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . 0.731 ' OE2' ' NZ ' ' Y' ' 9' ' ' LYS . 16.8 mt-10 -65.73 -41.79 91.8 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.189 -1.004 . . . . 63.950000000000003 110.259 178.852 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.3 -45.21 54.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.095 -1.042 . . . . 61.700000000000003 109.33 170.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . 0.595 ' N ' ' O ' ' A' ' 11' ' ' LEU . 3.2 tp -64.69 -39.35 93.51 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.81 -0.756 . . . . 59.329999999999998 111.696 179.64 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . 0.642 ' NE2' ' OE2' ' A' ' 19' ' ' GLU . 15.1 t-160 -55.81 -49.83 72.15 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 109.175 -0.676 . . . . 56.170000000000002 109.175 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -71.22 -22.71 61.97 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.542 -0.863 . . . . 78.450000000000003 110.948 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.81 -41.59 82.89 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.691 -0.404 . . . . 58.009999999999998 110.528 174.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.1 mt -57.55 -48.31 83.35 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.396 0.617 . . . . 56.950000000000003 110.059 169.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . 0.642 ' OE2' ' NE2' ' A' ' 15' ' ' HIS . 52.8 mt-10 -58.88 -46.56 87.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.152 0.501 . . . . 57.280000000000001 110.904 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . . . -70.78 -39.61 73.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.585 -0.279 . . . . 67.620000000000005 110.805 -178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tt -50.56 -56.23 12.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.464 0.649 . . . . 79.670000000000002 110.281 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -62.28 -46.75 87.41 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.943 -0.572 . . . . 72.5 110.986 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -61.91 -63.77 1.15 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.243 -0.583 . . . . 70.200000000000003 110.901 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 2.9 m95 -85.01 50.25 1.9 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.871 0.843 . . . . 76.109999999999999 111.061 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.5 86.76 0.36 Allowed Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.493 -1.043 . . . . 66.489999999999995 110.493 167.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.967 -0.117 . . . . 61.689999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 CA--C 1.524 -0.056 0 CA-C-O 120.885 0.374 . . . . 80.969999999999999 111.252 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' LYS . . . . . . . . . . . . . . . 55.33 31.27 16.38 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.737 -0.665 . . . . 98.010000000000005 111.777 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.82 13.89 1.23 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.639 0.607 . . . . 93.739999999999995 112.639 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LEU . . . . . 0.569 ' O ' ' N ' ' B' ' 7' ' ' LEU . . . -118.93 -44.48 2.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 123.392 0.677 . . . . 83.409999999999997 112.434 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . . . -50.49 -17.99 0.58 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 113.024 0.75 . . . . 80.730000000000004 113.024 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . . . -51.13 -37.28 45.17 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 120.115 -0.634 . . . . 73.920000000000002 110.387 165.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LEU . . . . . 0.569 ' N ' ' O ' ' B' ' 4' ' ' LEU . 1.5 tm? -52.22 -48.38 65.16 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.019 -0.673 . . . . 62.520000000000003 109.853 171.197 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.3 -40.86 95.73 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.752 -0.779 . . . . 67.560000000000002 110.884 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -67.32 -48.3 67.99 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.13 -0.628 . . . . 71.030000000000001 110.867 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' LEU . . . . . . . . . . . . . . . -63.63 -28.82 70.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.076 -0.65 . . . . 82.379999999999995 110.935 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.13 -48.58 67.63 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 120.409 -0.516 . . . . 75.170000000000002 110.303 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . . . -65.87 -41.46 91.58 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.223 -0.591 . . . . 83.439999999999998 110.876 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.04 -44.08 30.78 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.239 -0.584 . . . . 80.0 110.83 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tt -72.12 -40.35 68.2 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 111.896 0.332 . . . . 80.019999999999996 111.896 -177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -49.55 -50.68 41.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.107 0.479 . . . . 72.569999999999993 110.152 172.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' LYS . . . . . . . . . . . . . 49.5 mmtt -68.67 -39.08 80.77 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.304 -0.407 . . . . 75.189999999999998 111.825 -176.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -43.44 78.92 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.05 -0.66 . . . . 89.299999999999997 111.488 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ILE . . . . . . . . . . . . . 9.7 mm -68.03 -33.72 62.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 119.784 -0.766 . . . . 94.299999999999997 109.972 176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -53.39 -53.84 45.36 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.905 0.384 . . . . 81.090000000000003 110.969 171.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . . . -62.3 -48.6 79.16 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.27 -0.572 . . . . 79.379999999999995 111.426 -179.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LEU . . . . . . . . . . . . . . . -57.43 -55.73 31.07 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.976 0.417 . . . . 81.040000000000006 111.08 -176.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . . . -66.87 -19.67 65.78 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.015 -0.674 . . . . 94.170000000000002 112.235 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . . . -72.2 -50.34 28.37 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.511 0.596 . . . . 83.819999999999993 110.794 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' TRP . . . . . . . . . . . . . 12.0 m95 . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 118.979 -1.088 . . . . 99.170000000000002 109.741 174.027 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.513 -0.451 0 CA-C-O 122.085 0.945 . . . . 63.670000000000002 110.434 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.07 -29.48 65.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.246 -1.343 . . . . 57.979999999999997 112.204 -161.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' C' ' 101' ' ' HOH . 7.0 tp -69.85 -40.48 75.78 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.911 -1.516 . . . . 59.920000000000002 111.15 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 mt -63.73 -38.27 90.47 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.668 -0.813 . . . . 47.140000000000001 110.799 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.72 -44.12 94.53 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.025 -0.67 . . . . 52.700000000000003 110.774 173.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -48.84 -49.32 39.79 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.616 0.722 . . . . 52.090000000000003 109.977 172.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' LEU . . . . . . . . . . . . . 8.5 tp -54.17 -50.4 67.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.242 -0.89 . . . . 58.329999999999998 110.643 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ARG . . . . . 0.622 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 8.0 ttp85 -59.59 -46.58 88.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.505 -0.478 . . . . 51.719999999999999 111.605 -176.288 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' LYS . . . . . 0.476 ' NZ ' ' O2 ' ' A' ' 101' ' ' MPD . 12.5 mmmt -66.37 -38.65 88.05 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 118.417 -1.313 . . . . 41.990000000000002 110.28 -178.587 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' LEU . . . . . . . . . . . . . 3.2 tp -50.56 -48.41 57.47 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.095 0.474 . . . . 55.18 110.804 168.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -71.74 -48.39 47.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.732 -0.387 . . . . 43.340000000000003 111.121 -169.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -61.8 -31.74 71.98 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.413 -0.915 . . . . 45.490000000000002 110.29 176.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.13 -47.5 85.66 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.774 -0.77 . . . . 49.75 110.274 171.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' LEU . . . . . . . . . . . . . 2.1 tp -53.05 -46.93 68.75 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.278 0.561 . . . . 53.57 110.926 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' HIS . . . . . . . . . . . . . . . -77.12 -36.63 55.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.145 -0.48 . . . . 63.960000000000001 111.588 -171.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mmtt -73.32 -14.82 61.37 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.603 -0.839 . . . . 57.390000000000001 111.558 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.08 -46.63 17.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.961 0.41 . . . . 55.560000000000002 110.914 168.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 42.7 mt -57.58 -39.91 72.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.467 -0.493 . . . . 53.240000000000002 110.426 175.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.35 -63.89 0.84 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.172 0.51 . . . . 73.189999999999998 111.144 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' LEU . . . . . 0.672 ' O ' ' CB ' ' C' ' 24' ' ' TRP . 1.0 OUTLIER -67.72 -30.51 70.02 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.995 -0.682 . . . . 77.519999999999996 111.494 -177.428 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 12.5 tp -58.86 -41.57 87.35 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.195 -1.002 . . . . 59.0 110.548 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -55.15 -63.09 1.27 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.934 0.397 . . . . 72.340000000000003 110.805 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 mmmm -79.82 19.04 0.71 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.634 0.605 . . . . 70.099999999999994 112.634 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' TRP . . . . . 0.672 ' CB ' ' O ' ' C' ' 20' ' ' LEU . 80.2 m95 . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 112.827 0.677 . . . . 99.370000000000005 112.827 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' SER . . . . . 0.455 ' OG ' ' N ' ' D' ' 2' ' ' LYS . 0.9 OUTLIER . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 121.295 0.569 . . . . 71.730000000000004 111.688 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' LYS . . . . . 0.455 ' N ' ' OG ' ' D' ' 1' ' ' SER . 7.5 mtmt -56.61 -67.86 0.27 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.788 -1.096 . . . . 86.230000000000004 111.339 -166.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' LEU . . . . . . . . . . . . . 5.3 tt -67.38 -25.01 65.75 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.088 -1.045 . . . . 86.640000000000001 111.274 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' LEU . . . . . . . . . . . . . 2.1 mt -60.83 -59.78 4.84 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.274 -0.571 . . . . 66.769999999999996 110.404 -174.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' GLU . . . . . . . . . . . . . . . -52.99 -36.68 60.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.196 0.522 . . . . 68.629999999999995 110.811 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tt -58.23 -56.24 24.62 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.36 0.6 . . . . 87.069999999999993 110.909 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 mt -57.46 -37.35 72.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.576 -0.85 . . . . 71.390000000000001 110.658 178.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' ARG . . . . . . . . . . . . . . . -56.16 -61.62 2.26 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.345 -0.542 . . . . 62.920000000000002 110.65 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' LYS . . . . . 0.707 ' NZ ' ' O ' ' D' ' 101' ' ' HOH . 26.2 mmtt -59.89 -32.92 71.19 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.01 -1.076 . . . . 69.269999999999996 110.811 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' LEU . . . . . . . . . . . . . 3.7 mt -54.72 -40.99 69.81 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.009 -0.677 . . . . 71.099999999999994 110.789 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 7.9 mt -69.09 -40.49 78.37 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 120.198 -0.601 . . . . 63.560000000000002 111.227 -179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' GLU . . . . . 0.691 ' OE2' ' NZ ' ' D' ' 9' ' ' LYS . 2.2 tt0 -57.29 -43.67 83.4 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 119.711 -0.796 . . . . 76.890000000000001 109.808 175.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.54 79.79 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.45 -0.341 . . . . 62.219999999999999 111.033 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' LEU . . . . . 0.549 ' O ' ' CD1' ' D' ' 18' ' ' ILE . 59.8 tp -56.78 -64.44 0.87 Allowed 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.581 -0.848 . . . . 65.219999999999999 109.892 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -53.12 -30.29 35.83 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.177 -1.009 . . . . 97.819999999999993 111.296 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.02 -61.13 2.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.514 -0.874 . . . . 69.560000000000002 110.986 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.43 -30.26 69.51 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.188 -1.005 . . . . 62.520000000000003 111.123 -178.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' ILE . . . . . 0.549 ' CD1' ' O ' ' D' ' 14' ' ' LEU . 45.1 mm -57.14 -43.88 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.297 0.57 . . . . 65.780000000000001 109.572 174.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.13 0.49 . . . . 69.829999999999998 110.511 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' LEU . . . . . . . . . . . . . 15.7 mt -42.84 -57.8 2.64 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.291 0.567 . . . . 56.710000000000001 109.686 175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 tt -57.47 -67.1 0.36 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.057 -0.52 . . . . 86.120000000000005 110.692 177.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -46.66 -24.92 0.62 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.022 -0.535 . . . . 94.590000000000003 112.112 -168.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' LYS . . . . . . . . . . . . . . . -50.93 -59.1 4.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.128 0.489 . . . . 79.180000000000007 111.19 170.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 O-C-N 122.13 -0.356 . . . . 87.780000000000001 110.854 179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 1' ' ' SER . . . . . 0.743 ' OG ' ' N ' ' E' ' 2' ' ' LYS . 1.2 t . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 55.350000000000001 109.126 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 2' ' ' LYS . . . . . 0.743 ' N ' ' OG ' ' E' ' 1' ' ' SER . 19.7 mttt 65.77 -8.59 0.3 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.934 0.716 . . . . 46.759999999999998 112.934 162.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 3' ' ' LEU . . . . . . . . . . . . . 10.2 tp -119.67 -34.48 3.76 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.585 -0.697 . . . . 50.409999999999997 112.808 171.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 4' ' ' LEU . . . . . . . . . . . . . 9.7 mt -53.95 -33.6 57.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 118.909 -1.116 . . . . 53.229999999999997 109.478 161.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 5' ' ' GLU . . . . . . . . . . . . . . . -58.07 -55.34 36.17 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.994 0.426 . . . . 47.719999999999999 111.033 172.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 6' ' ' LEU . . . . . . . . . . . . . 6.1 tt -61.32 -52.12 65.99 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.009 -0.676 . . . . 55.740000000000002 110.792 -177.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 7' ' ' LEU . . . . . . . . . . . . . 4.2 tp -44.35 -52.15 7.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 59.07 110.369 174.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 8' ' ' ARG . . . . . 0.508 ' NH2' ' O3 ' ' E' ' 101' ' ' PO4 . 2.0 ttp85 -58.98 -45.45 90.55 Favored 'General case' 0 C--O 1.191 -1.998 0 N-CA-C 115.764 1.765 . . . . 59.75 115.764 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 9' ' ' LYS . . . . . . . . . . . . . 10.3 mttm -79.44 -31.24 42.49 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.616 -0.677 . . . . 47.340000000000003 112.003 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.18 -46.95 79.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 119.76 -0.776 . . . . 39.869999999999997 110.14 169.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 11' ' ' LEU . . . . . . . . . . . . . 95.9 mt -63.08 -41.34 99.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.845 -0.742 . . . . 57.039999999999999 111.28 -178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.99 -37.99 84.46 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.039 -1.064 . . . . 66.340000000000003 110.084 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 13' ' ' ALA . . . . . . . . . . . . . . . -57.12 -47.31 81.42 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.109 0.48 . . . . 34.649999999999999 110.648 172.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 mt -54.16 -46.07 72.2 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.985 0.421 . . . . 58.280000000000001 111.522 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 15' ' ' HIS . . . . . 0.505 ' NE2' ' OE1' ' E' ' 19' ' ' GLU . 15.5 t-160 -65.49 -43.5 90.02 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.761 0.315 . . . . 45.409999999999997 111.073 -174.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 16' ' ' LYS . . . . . 0.434 ' NZ ' ' CB ' ' E' ' 19' ' ' GLU . 27.6 mmtt -70.42 -33.56 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.579 -1.248 . . . . 54.670000000000002 111.167 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.15 -47.07 82.08 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.133 -0.627 . . . . 62.439999999999998 110.267 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 18' ' ' ILE . . . . . 0.463 ' O ' ' N ' ' E' ' 21' ' ' LEU . 27.8 mt -52.32 -54.48 14.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 121.492 0.663 . . . . 56.420000000000002 109.853 176.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 19' ' ' GLU . . . . . 0.505 ' OE1' ' NE2' ' E' ' 15' ' ' HIS . 53.8 mt-10 -59.35 -51.7 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.264 -0.574 . . . . 52.0 111.344 -173.237 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 pp -69.54 -28.48 66.05 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.258 -1.377 . . . . 80.189999999999998 111.519 -175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 21' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' E' ' 18' ' ' ILE . 3.9 tp -57.25 -52.15 66.49 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 119.986 -0.685 . . . . 100.87 110.211 170.178 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' E' E ' 22' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.75 -32.48 63.85 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.29 -0.964 . . . . 105.44 112.149 -172.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 23' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -66.84 -61.72 1.81 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 120.634 -0.426 . . . . 81.299999999999997 111.237 -165.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 24' ' ' TRP . . . . . . . . . . . . . 13.6 p-90 -90.61 84.2 5.89 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 106.664 -1.606 . . . . 72.010000000000005 106.664 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 25' ' ' GLY . . . . . . . . . . . . . . . 140.21 -126.8 3.31 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.006 -1.238 . . . . 80.870000000000005 110.006 -171.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.822 0.311 . . . . 77.579999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.224 -0.237 0 CA-C-O 121.16 0.505 . . . . 70.0 110.45 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 2' ' ' LYS . . . . . . . . . . . . . . . -71.64 9.98 0.75 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 122.972 1.368 . . . . 68.569999999999993 112.641 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 tt -61.44 -42.83 99.37 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.855 -1.066 . . . . 60.359999999999999 111.122 174.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.65 -41.15 89.92 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.956 -0.698 . . . . 84.189999999999998 110.241 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.49 -35.72 81.4 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.063 -0.655 . . . . 107.65000000000001 110.864 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 tp -56.77 -43.2 80.59 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.375 0.607 . . . . 79.109999999999999 110.484 173.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.69 -42.74 97.95 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.921 -0.712 . . . . 51.229999999999997 110.89 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 8' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -59.27 -39.08 81.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.94 0.4 . . . . 78.0 111.157 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.74 -48.66 68.46 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.463 -0.495 . . . . 53.170000000000002 110.873 -179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 10' ' ' LEU . . . . . . . . . . . . . 7.9 mt -58.36 -34.52 70.76 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 118.461 -1.296 . . . . 59.109999999999999 110.687 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mt -62.15 -62.28 1.88 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.552 -0.459 . . . . 56.079999999999998 110.866 176.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -50.12 -38.46 39.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.895 0.378 . . . . 87.709999999999994 110.788 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.47 85.33 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.45 -0.5 . . . . 54.07 111.145 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 14' ' ' LEU . . . . . . . . . . . . . 29.0 tp -64.39 -36.47 84.24 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 118.91 -1.116 . . . . 56.469999999999999 111.081 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 15' ' ' HIS . . . . . 0.718 ' ND1' ' O ' ' F' ' 101' ' ' HOH . 1.2 t60 -54.56 -52.68 61.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.864 -0.735 . . . . 65.909999999999997 110.247 176.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' F' F ' 16' ' ' LYS . . . . . . . . . . . . . 8.6 mttt -61.27 -40.83 95.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.059 -0.519 . . . . 78.370000000000005 110.918 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.1 79.36 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 120.07 -0.652 . . . . 54.920000000000002 110.985 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 18' ' ' ILE . . . . . . . . . . . . . . . -68.26 -49.84 63.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.653 0.739 . . . . 59.530000000000001 110.441 178.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.59 -34.46 67.2 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.161 -0.616 . . . . 70.150000000000006 110.911 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 20' ' ' LEU . . . . . . . . . . . . . . . -76.27 -36.6 58.34 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.261 -0.576 . . . . 62.740000000000002 111.826 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 21' ' ' LEU . . . . . . . . . . . . . 2.6 mt -51.62 -46.37 63.6 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.271 0.558 . . . . 70.719999999999999 109.902 170.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.51 -49.78 76.47 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.359 -0.536 . . . . 79.810000000000002 110.932 171.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 23' ' ' LYS . . . . . . . . . . . . . 54.6 tptt -57.38 -40.17 77.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.467 -0.333 . . . . 86.620000000000005 111.753 -168.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 24' ' ' TRP . . . . . . . . . . . . . 1.6 m95 -109.17 -53.6 2.63 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.246 0.832 . . . . 92.609999999999999 113.246 -176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 25' ' ' GLY . . . . . . . . . . . . . . . -73.73 -91.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.866 -0.683 . . . . 90.25 113.105 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.051 . . . . 84.599999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 1' ' ' SER . . . . . . . . . . . . . 28.7 t . . . . . 0 C--O 1.237 0.406 0 CA-C-O 121.508 0.67 . . . . 59.689999999999998 109.55 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -60.65 -26.09 66.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.028 -0.987 . . . . 66.060000000000002 111.364 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 3' ' ' LEU . . . . . . . . . . . . . 1.2 mp -59.85 -58.59 7.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.223 0.535 . . . . 65.099999999999994 110.822 174.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.96 -34.79 78.26 Favored 'General case' 0 CA--C 1.509 -0.608 0 C-N-CA 120.838 -0.345 . . . . 43.039999999999999 111.51 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 5' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -73.26 -30.43 63.45 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 117.874 -1.531 . . . . 44.229999999999997 110.978 -179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 tp -56.07 -46.87 78.83 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.453 0.644 . . . . 49.07 110.042 165.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.19 -39.8 72.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.864 -0.607 . . . . 45.670000000000002 110.796 176.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -60.63 -51.66 68.45 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.051 -0.522 . . . . 64.530000000000001 110.979 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 9' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -59.58 -38.67 81.81 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.319 -0.952 . . . . 34.75 110.036 178.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -55.86 -52.72 63.07 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.946 -0.702 . . . . 47.700000000000003 110.985 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 11' ' ' LEU . . . . . . . . . . . . . 20.5 mt -65.34 -42.79 92.53 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.688 0.255 . . . . 36.25 111.688 -173.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -62.47 -38.06 88.37 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.188 -1.005 . . . . 37.25 110.489 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.71 87.7 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.555 -0.858 . . . . 50.079999999999998 110.431 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.58 -43.48 65.31 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.265 -0.425 . . . . 47.520000000000003 109.992 173.395 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' G' G ' 15' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -61.91 -43.28 99.17 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.163 -0.471 . . . . 44.840000000000003 111.043 -177.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -69.22 -37.68 78.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.143 -1.023 . . . . 48.93 111.202 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.04 91.14 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 119.902 -0.719 . . . . 46.560000000000002 110.683 174.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 18' ' ' ILE . . . . . . . . . . . . . 4.2 mt -49.34 -53.48 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.021 -0.536 . . . . 46.630000000000003 109.892 174.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.93 -37.12 85.77 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.181 -0.608 . . . . 43.479999999999997 111.596 -175.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 20' ' ' LEU . . . . . . . . . . . . . 5.7 mt -63.62 -48.86 75.58 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 118.846 -1.142 . . . . 58.670000000000002 110.397 177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 21' ' ' LEU . . . . . . . . . . . . . . . -55.9 -41.63 74.79 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.006 0.431 . . . . 61.259999999999998 111.079 178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 22' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -63.15 -40.99 99.16 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.234 -0.587 . . . . 64.420000000000002 110.742 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -55.53 -34.15 64.43 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.497 -0.881 . . . . 64.519999999999996 111.053 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 24' ' ' TRP . . . . . 0.459 ' O ' ' O ' ' G' ' 101' ' ' HOH . 2.0 m95 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 119.481 -0.887 . . . . 58.700000000000003 111.888 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 1' ' ' SER . . . . . 0.477 ' N ' ' O ' ' H' ' 102' ' ' HOH . 1.4 t . . . . . 0 CA--C 1.522 -0.127 0 N-CA-C 111.517 0.192 . . . . 62.299999999999997 111.517 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.21 -24.75 56.67 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.952 -0.567 . . . . 62.090000000000003 112.266 -176.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 3' ' ' LEU . . . . . . . . . . . . . 6.6 tt -59.64 -33.29 71.33 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.283 -0.567 . . . . 60.090000000000003 110.991 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -47.38 -63.3 1.08 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.56 0.695 . . . . 68.950000000000003 110.267 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.9 -33.58 74.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.86 -0.609 . . . . 70.569999999999993 111.531 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 6' ' ' LEU . . . . . . . . . . . . . 13.9 tp -57.12 -46.34 82.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.643 -0.823 . . . . 50.369999999999997 110.797 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.51 -37.81 71.18 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.255 -0.43 . . . . 64.090000000000003 111.021 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 8' ' ' ARG . . . . . . . . . . . . . . . -52.1 -42.94 63.66 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.234 -0.987 . . . . 82.140000000000001 110.016 170.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 9' ' ' LYS . . . . . . . . . . . . . . . -64.63 -47.12 79.72 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.295 0.569 . . . . 69.760000000000005 110.829 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 10' ' ' LEU . . . . . . . . . . . . . 1.5 mt -56.63 -48.01 78.44 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.088 -1.045 . . . . 55.759999999999998 110.113 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 tt -56.42 -40.88 75.46 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.8 -0.36 . . . . 59.920000000000002 111.264 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.66 -50.82 40.38 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 119.887 -0.725 . . . . 75.569999999999993 111.06 -175.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.75 -37.24 28.8 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.106 0.479 . . . . 60.700000000000003 109.969 171.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.9 -45.34 71.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.974 -0.557 . . . . 62.049999999999997 110.982 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 15' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -67.58 -39.1 84.85 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 118.194 -1.403 . . . . 68.849999999999994 110.507 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 16' ' ' LYS . . . . . . . . . . . . . . . -54.42 -47.43 72.81 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.689 0.756 . . . . 58.109999999999999 110.427 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.32 59.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.756 -0.656 . . . . 53.450000000000003 110.805 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -72.47 -28.69 28.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 118.239 -1.384 . . . . 63.890000000000001 110.791 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 19' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.64 -53.21 41.06 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.241 0.543 . . . . 77.739999999999995 110.092 165.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 mt -60.61 -34.65 74.54 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.472 -0.891 . . . . 68.349999999999994 110.535 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 21' ' ' LEU . . . . . . . . . . . . . 2.9 tt -63.3 -50.34 70.46 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.21 0.528 . . . . 72.890000000000001 110.389 -176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 22' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -65.75 -36.88 84.81 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.23 -0.588 . . . . 103.98 110.709 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 23' ' ' LYS . . . . . . . . . . . . . . . -64.33 -22.23 66.88 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.736 -0.786 . . . . 89.219999999999999 111.709 175.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 24' ' ' TRP . . . . . . . . . . . . . 5.8 m95 . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 108.794 -0.817 . . . . 79.909999999999997 108.794 175.68 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' I' I ' 1' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 1 C--O 1.148 -4.273 0 N-CA-C 107.583 -1.266 . . . . 66.969999999999999 107.583 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -34.53 14.35 Favored 'General case' 0 C--O 1.19 -2.04 0 N-CA-C 117.08 2.252 . . . . 63.950000000000003 117.08 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 9.6 tp -65.94 -42.75 89.63 Favored 'General case' 0 C--O 1.186 -2.287 0 C-N-CA 125.0 1.32 . . . . 43.649999999999999 107.706 173.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 mt -65.94 -30.73 71.35 Favored 'General case' 0 C--O 1.194 -1.853 0 CA-C-O 118.446 -0.788 . . . . 55.619999999999997 112.528 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 5' ' ' GLU . . . . . . . . . . . . . . . -70.36 -40.97 73.73 Favored 'General case' 0 C--O 1.162 -3.529 0 N-CA-C 105.772 -1.936 . . . . 46.810000000000002 105.772 176.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 6' ' ' LEU . . . . . . . . . . . . . 9.5 tp -60.44 -44.61 95.64 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 117.862 -1.535 . . . . 46.969999999999999 110.465 173.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.11 -45.64 75.51 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.443 0.64 . . . . 44.799999999999997 110.273 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 8' ' ' ARG . . . . . 0.481 ' NH1' ' O4 ' ' I' ' 101' ' ' PO4 . 14.1 ttp85 -61.32 -48.79 79.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.565 -0.743 . . . . 42.950000000000003 110.986 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 9' ' ' LYS . . . . . . . . . . . . . 33.6 mmtt -61.26 -37.21 82.29 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 118.76 -1.176 . . . . 39.359999999999999 110.586 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.23 -52.74 60.98 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.184 0.516 . . . . 42.93 110.749 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 11' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.26 -45.12 80.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 36.439999999999998 110.897 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 12' ' ' GLU . . . . . 0.571 ' OE1' ' NZ ' ' K' ' 9' ' ' LYS . 26.5 mt-10 -58.63 -61.43 2.61 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 118.581 -1.248 . . . . 48.329999999999998 110.173 176.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' I' I ' 13' ' ' ALA . . . . . . . . . . . . . . . -39.79 -48.3 2.21 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.158 0.504 . . . . 35.960000000000001 111.725 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 pp -73.2 -32.37 64.76 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 118.071 -1.452 . . . . 57.759999999999998 111.592 -177.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 15' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -60.09 -38.26 82.39 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.725 -1.59 . . . . 46.149999999999999 110.187 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.83 -37.57 79.58 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.712 -0.395 . . . . 46.409999999999997 110.866 174.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.28 84.28 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.251 -0.979 . . . . 60.280000000000001 110.292 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 18' ' ' ILE . . . . . . . . . . . . . 24.2 mt -51.18 -49.53 29.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.728 0.775 . . . . 60.210000000000001 109.696 176.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 19' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -59.63 -48.64 80.88 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.648 -0.706 . . . . 57.869999999999997 111.112 -175.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.28 -41.97 98.94 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.221 -0.991 . . . . 73.069999999999993 110.431 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 tt -59.81 -58.63 7.75 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.289 -0.565 . . . . 95.079999999999998 110.64 -177.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 22' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.26 -37.39 62.08 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.079 -1.049 . . . . 67.980000000000004 110.878 -168.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 23' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -70.7 -44.85 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.279 -0.968 . . . . 63.859999999999999 110.79 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 24' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 120.116 -0.634 . . . . 76.510000000000005 111.73 -176.6 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 120.591 0.234 . . . . 80.180000000000007 110.463 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 2' ' ' LYS . . . . . . . . . . . . . . . -56.85 -6.87 0.38 Allowed 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.423 0.527 . . . . 73.329999999999998 112.423 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 3' ' ' LEU . . . . . . . . . . . . . 11.4 tp -36.44 -44.45 0.43 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.587 1.155 . . . . 63.590000000000003 110.402 161.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.26 -43.09 71.22 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.667 -0.813 . . . . 72.629999999999995 111.583 -175.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.68 -41.96 98.27 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 119.186 -1.006 . . . . 68.180000000000007 110.369 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -53.93 -43.53 69.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.478 . . . . 60.600000000000001 110.613 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.33 -53.11 62.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.083 0.468 . . . . 59.640000000000001 110.818 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 8' ' ' ARG . . . . . . . . . . . . . . . -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 63.359999999999999 110.481 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.86 -35.26 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.536 -0.866 . . . . 59.899999999999999 111.274 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 10' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.21 -48.15 81.28 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 118.919 -1.112 . . . . 56.140000000000001 109.892 177.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.01 -43.25 73.48 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.18 0.514 . . . . 59.009999999999998 110.789 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.43 -52.51 57.75 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.397 -0.521 . . . . 72.920000000000002 110.531 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.94 -33.69 57.54 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.756 -0.377 . . . . 59.789999999999999 110.404 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 14' ' ' LEU . . . . . . . . . . . . . 59.4 tp -65.22 -49.35 70.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.157 0.503 . . . . 60.640000000000001 110.86 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 15' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -66.39 -31.07 71.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 118.145 -1.422 . . . . 77.689999999999998 110.92 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 16' ' ' LYS . . . . . . . . . . . . . . . -61.5 -46.39 90.21 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.214 0.53 . . . . 65.879999999999995 110.335 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.31 85.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.333 -0.394 . . . . 62.990000000000002 111.333 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 18' ' ' ILE . . . . . . . . . . . . . . . -62.97 -48.02 90.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.73 0.776 . . . . 70.629999999999995 109.976 -177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -73.07 -26.65 61.35 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.595 -0.842 . . . . 125.02 111.3 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 20' ' ' LEU . . . . . . . . . . . . . 11.8 tp -63.45 -35.24 79.79 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.943 -1.103 . . . . 80.459999999999994 110.272 169.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 21' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' J' ' 26' ' ' NH2 . 1.5 tt -64.38 -37.22 86.75 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.93 -0.708 . . . . 61.329999999999998 110.156 172.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.16 -47.16 86.33 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.835 -0.746 . . . . 79.640000000000001 110.567 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -73.59 -41.62 62.65 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.302 -0.559 . . . . 93.950000000000003 111.476 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 24' ' ' TRP . . . . . 0.579 ' NE1' ' O ' ' J' ' 101' ' ' HOH . 5.0 m0 -82.65 -66.59 0.87 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.095 0.474 . . . . 81.049999999999997 110.451 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' J' J ' 25' ' ' GLY . . . . . . . . . . . . . . . -90.95 -90.28 1.35 Allowed Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 108.699 -1.761 . . . . 90.640000000000001 108.699 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' J' J ' 26' ' ' NH2 . . . . . 0.648 ' N ' ' O ' ' J' ' 21' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.13 -0.041 . . . . 83.159999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 1' ' ' SER . . . . . . . . . . . . . 5.1 p . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.333 0.587 . . . . 38.539999999999999 110.973 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 2' ' ' LYS . . . . . . . . . . . . . 2.5 ttmt -77.85 -46.66 20.8 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 119.09 -1.044 . . . . 68.269999999999996 110.648 -174.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 tp -59.45 -38.47 80.84 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 118.531 -1.268 . . . . 32.369999999999997 110.349 170.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 4' ' ' LEU . . . . . . . . . . . . . 4.7 mt -46.52 -61.59 1.75 Allowed 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.685 -0.806 . . . . 24.600000000000001 108.93 173.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 5' ' ' GLU . . . . . . . . . . . . . . . -50.73 -41.04 55.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.775 -0.648 . . . . 18.289999999999999 111.135 179.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 tt -56.65 -44.93 81.81 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 118.69 -1.204 . . . . 50.049999999999997 110.313 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.78 -44.55 85.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.078 0.466 . . . . 49.039999999999999 110.499 -177.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 8' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -53.07 -59.6 4.34 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.907 -0.588 . . . . 64.299999999999997 110.693 177.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 9' ' ' LYS . . . . . 0.571 ' NZ ' ' OE1' ' I' ' 12' ' ' GLU . 15.7 mmtt -62.38 -30.26 71.07 Favored 'General case' 0 C--O 1.16 -3.652 0 O-C-N 121.379 -0.825 . . . . 28.23 112.727 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 tp -67.55 -53.43 28.46 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 119.748 -0.781 . . . . 67.340000000000003 110.541 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 11' ' ' LEU . . . . . 0.553 ' O ' ' NH2' ' M' ' 8' ' ' ARG . 33.4 mt -59.79 -38.3 81.51 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 120.842 -0.343 . . . . 28.239999999999998 110.677 -179.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.41 -50.61 70.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.683 -0.807 . . . . 55.729999999999997 110.553 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.97 -48.96 69.8 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.645 0.736 . . . . 41.57 110.793 176.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.68 -49.48 47.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.511 -0.768 . . . . 65.060000000000002 110.469 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 15' ' ' HIS . . . . . 0.415 ' CB ' ' NH2' ' M' ' 8' ' ' ARG . 2.2 t-80 -61.21 -36.42 79.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.784 -0.644 . . . . 83.719999999999999 110.999 -177.358 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.91 -34.04 62.11 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 118.047 -1.461 . . . . 63.630000000000003 111.123 -176.353 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' K' K ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.49 -48.01 75.26 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.66 -0.816 . . . . 41.979999999999997 110.657 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 18' ' ' ILE . . . . . . . . . . . . . 47.2 mt -54.47 -48.72 69.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.356 0.598 . . . . 37.939999999999998 109.95 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 19' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.11 -33.21 75.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.383 . . . . 63.950000000000003 111.731 -175.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mt -71.56 -34.72 70.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 118.728 -1.189 . . . . 55.909999999999997 111.268 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 21' ' ' LEU . . . . . . . . . . . . . . . -66.82 -30.37 70.54 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.333 -0.947 . . . . 46.759999999999998 111.378 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 22' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -85.5 -8.5 58.31 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.738 0.644 . . . . 43.420000000000002 112.738 176.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -87.11 -25.45 24.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.724 -0.391 . . . . 62.859999999999999 111.358 162.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 24' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -123.64 36.6 4.6 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 122.937 0.495 . . . . 72.319999999999993 112.026 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 25' ' ' GLY . . . . . . . . . . . . . . . 158.75 -126.16 1.63 Allowed Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.898 -0.881 . . . . 56.93 110.898 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 123.524 0.19 . . . . 52.170000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 122.122 0.963 . . . . 72.549999999999997 110.954 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.45 -37.35 7.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.031 -1.44 . . . . 67.640000000000001 108.612 166.24 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 3' ' ' LEU . . . . . . . . . . . . . 10.1 tp -57.91 -44.99 87.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.074 0.464 . . . . 92.569999999999993 110.723 173.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 26.1 tp -63.3 -40.42 97.29 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 118.382 -1.327 . . . . 66.900000000000006 110.373 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.2 -42.29 94.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.479 -0.889 . . . . 51.649999999999999 109.981 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -51.22 -49.53 60.89 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.75 0.786 . . . . 64.879999999999995 110.752 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 tt -61.86 -45.28 94.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.528 -0.76 . . . . 63.829999999999998 111.163 -179.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 8' ' ' ARG . . . . . . . . . . . . . . . -63.94 -39.03 93.22 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.647 -0.421 . . . . 66.980000000000004 110.986 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 9' ' ' LYS . . . . . 0.736 ' NZ ' ' O ' ' L' ' 101' ' ' HOH . 35.6 mmtt -67.38 -37.47 83.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.657 -1.217 . . . . 65.200000000000003 110.234 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 mt -55.98 -36.92 68.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.058 -1.057 . . . . 52.670000000000002 110.842 171.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -61.92 -58.51 7.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.177 -0.465 . . . . 56.979999999999997 111.179 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -57.49 -33.16 67.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.784 -0.766 . . . . 62.409999999999997 110.511 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.65 68.23 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 121.706 -0.621 . . . . 48.189999999999998 111.057 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 14' ' ' LEU . . . . . . . . . . . . . 4.4 tp -59.71 -34.17 72.57 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 120.412 -0.515 . . . . 75.760000000000005 111.017 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 15' ' ' HIS . . . . . . . . . . . . . . . -58.09 -50.76 72.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.82 0.343 . . . . 58.619999999999997 110.197 173.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 16' ' ' LYS . . . . . 0.565 ' NZ ' ' O ' ' L' ' 103' ' ' HOH . 20.8 mmtt -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 118.473 -1.291 . . . . 60.5 110.665 -179.859 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.33 -58.22 5.8 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.956 -0.698 . . . . 51.299999999999997 110.515 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 18' ' ' ILE . . . . . . . . . . . . . 2.8 pt -59.72 -23.06 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 O-C-N 121.956 -0.465 . . . . 71.579999999999998 110.067 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.9 -48.6 73.62 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.004 0.43 . . . . 144.43000000000001 110.241 171.783 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' L' L ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 tp -56.22 -33.23 65.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.185 -0.606 . . . . 66.780000000000001 111.1 172.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.9 -18.51 33.9 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.559 0.948 . . . . 73.560000000000002 113.559 -171.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 22' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -81.03 -46.84 14.43 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.535 0.607 . . . . 112.51000000000001 112.576 -166.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -54.14 -31.05 51.31 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.662 -0.415 . . . . 94.010000000000005 111.549 -174.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 24' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 . . . . . 0 C--N 1.326 -0.45 0 C-N-CA 120.337 -0.545 . . . . 84.620000000000005 110.736 169.409 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' M' M ' 1' ' ' SER . . . . . 0.555 ' N ' ' O ' ' M' ' 203' ' ' HOH . 2.9 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-O 121.302 0.572 . . . . 53.850000000000001 110.102 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 2' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' M' ' 203' ' ' HOH . 9.7 mmtt -123.22 -28.57 3.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.241 -0.89 . . . . 67.260000000000005 112.84 179.703 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' M' M ' 3' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' M' ' 203' ' ' HOH . . . -57.14 -41.2 78.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.604 -0.839 . . . . 58.07 110.686 168.085 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' M' M ' 4' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.61 -40.23 84.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.221 -0.592 . . . . 86.060000000000002 110.934 -178.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 5' ' ' GLU . . . . . . . . . . . . . . . -54.98 -43.55 73.63 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.542 -0.463 . . . . 53.890000000000001 110.894 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -59.33 -43.84 92.68 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.396 -0.522 . . . . 36.43 111.165 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 7' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.49 -49.36 72.75 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 119.92 -0.712 . . . . 38.289999999999999 110.828 177.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 8' ' ' ARG . . . . . 0.68 ' NH1' ' O ' ' M' ' 201' ' ' HOH . 0.1 OUTLIER -68.14 -43.14 78.97 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.881 -1.128 . . . . 42.189999999999998 111.465 -173.614 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' M' M ' 9' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -61.13 -37.0 81.26 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 117.47 -1.692 . . . . 43.960000000000001 110.267 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 10' ' ' LEU . . . . . . . . . . . . . 26.7 tp -60.89 -57.85 10.9 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.354 -0.538 . . . . 38.789999999999999 110.264 178.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mt -65.82 -26.38 67.65 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 119.438 -0.905 . . . . 36.090000000000003 112.024 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 12' ' ' GLU . . . . . 0.408 ' OE1' ' O3 ' ' M' ' 101' ' ' PO4 . 21.5 mt-10 -70.17 -43.34 71.02 Favored 'General case' 0 C--O 1.178 -2.692 0 CA-C-N 120.065 1.302 . . . . 53.539999999999999 108.924 176.555 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' M' M ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.65 -41.87 77.94 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.855 -0.738 . . . . 42.539999999999999 109.764 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 14' ' ' LEU . . . . . . . . . . . . . 4.2 tp -62.0 -47.84 82.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.789 -0.641 . . . . 42.909999999999997 110.429 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 15' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -62.28 -39.08 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.388 -0.369 . . . . 44.82 110.98 -178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 16' ' ' LYS . . . . . 0.532 ' NZ ' ' O3 ' ' M' ' 101' ' ' PO4 . 40.8 mmtm -67.23 -39.02 86.18 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.708 -1.197 . . . . 74.980000000000004 110.328 177.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' M' M ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.42 -41.88 81.26 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.946 -0.702 . . . . 41.490000000000002 110.358 174.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 18' ' ' ILE . . . . . . . . . . . . . 24.3 mt -55.14 -63.84 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.301 -0.629 . . . . 46.32 109.301 174.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 19' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -48.17 -38.67 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.317 -0.553 . . . . 40.390000000000001 111.447 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 20' ' ' LEU . . . . . . . . . . . . . 6.9 mt -64.64 -50.19 68.06 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.959 -0.696 . . . . 36.450000000000003 110.49 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . . . -62.45 -30.55 71.32 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.994 -0.682 . . . . 67.379999999999995 111.376 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 22' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -73.26 -33.56 65.34 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.818 -0.753 . . . . 52.990000000000002 110.718 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.58 -25.02 38.77 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.076 -1.049 . . . . 69.840000000000003 112.289 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 m95 -106.85 9.08 31.0 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.53 0.937 . . . . 58.219999999999999 113.53 -173.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.04 -96.82 0.23 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.512 -0.851 . . . . 80.709999999999994 112.108 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 26' ' ' NH2 . . . . . 0.645 ' N ' ' O ' ' M' ' 202' ' ' HOH . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 122.927 -0.16 . . . . 76.180000000000007 . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 1' ' ' SER . . . . . . . . . . . . . 4.0 t . . . . . 0 CA--C 1.522 -0.127 0 CA-C-O 121.424 0.63 . . . . 64.739999999999995 110.242 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' N' N ' 2' ' ' LYS . . . . . . . . . . . . . . . -91.19 -10.46 41.62 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.192 -0.913 . . . . 63.240000000000002 112.553 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 3' ' ' LEU . . . . . . . . . . . . . 1.3 tt -49.93 -44.72 50.56 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.342 0.591 . . . . 76.189999999999998 109.874 169.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 4' ' ' LEU . . . . . . . . . . . . . . . -63.54 -45.73 89.21 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.999 -0.681 . . . . 65.170000000000002 110.678 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.3 -41.25 96.66 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 119.745 -0.782 . . . . 58.600000000000001 110.091 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 6' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.94 -42.07 93.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.495 -0.482 . . . . 52.289999999999999 110.602 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 7' ' ' LEU . . . . . . . . . . . . . 2.0 mt -57.96 -53.47 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 121.01 0.433 . . . . 57.850000000000001 110.706 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.08 -43.36 61.01 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.087 -0.506 . . . . 67.879999999999995 110.939 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 9' ' ' LYS . . . . . . . . . . . . . . . -71.61 -44.55 64.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.239 -0.584 . . . . 57.600000000000001 111.281 -174.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 10' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.45 -43.0 75.04 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 119.484 -0.887 . . . . 63.600000000000001 109.94 173.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 11' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.05 -44.63 91.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.105 0.479 . . . . 64.060000000000002 111.209 179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 12' ' ' GLU . . . . . . . . . . . . . . . -66.44 -45.57 79.38 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 119.837 -0.745 . . . . 78.819999999999993 110.585 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.78 -38.69 49.73 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.563 -0.455 . . . . 61.159999999999997 109.941 171.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -67.23 -41.54 85.5 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 120.512 -0.475 . . . . 62.0 110.508 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 15' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.51 -51.21 70.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 119.997 -0.681 . . . . 62.840000000000003 110.351 177.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' N' N ' 16' ' ' LYS . . . . . . . . . . . . . . . -65.41 -37.7 87.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.308 -0.557 . . . . 65.709999999999994 111.021 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.88 83.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.011 -0.675 . . . . 57.229999999999997 110.174 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mt -55.3 -44.68 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-O 121.431 0.634 . . . . 59.579999999999998 109.878 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 19' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -82.95 -29.81 28.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 117.737 -1.585 . . . . 77.379999999999995 112.0 -172.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.37 -31.75 73.09 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 118.548 -1.261 . . . . 71.849999999999994 109.796 170.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 21' ' ' LEU . . . . . . . . . . . . . 13.1 tp -66.38 -41.99 88.59 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.731 0.3 . . . . 68.049999999999997 110.752 172.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 22' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -55.91 -41.18 74.16 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.475 -0.49 . . . . 77.260000000000005 110.398 173.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' N' N ' 23' ' ' LYS . . . . . 0.549 ' NZ ' ' OG ' ' P' ' 1' ' ' SER . 25.5 ttpt -58.99 -63.8 1.17 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.914 0.388 . . . . 82.709999999999994 110.56 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' N' N ' 24' ' ' TRP . . . . . . . . . . . . . 1.1 p90 . . . . . 0 C--N 1.331 -0.212 0 CA-C-O 120.848 0.356 . . . . 94.790000000000006 110.685 173.553 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' O' O ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.513 -0.457 0 N-CA-C 109.14 -0.689 . . . . 45.810000000000002 109.14 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' O' O ' 2' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -121.84 -56.22 1.86 Allowed 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 112.593 0.59 . . . . 52.700000000000003 112.593 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -69.23 -45.34 70.04 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.273 -1.517 . . . . 40.539999999999999 110.557 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.29 -33.07 71.82 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.562 -0.855 . . . . 46.240000000000002 111.161 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 5' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -78.05 -28.69 49.02 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 117.932 -1.507 . . . . 37.170000000000002 111.364 178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 6' ' ' LEU . . . . . . . . . . . . . 1.8 tt -53.52 -46.2 70.03 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.452 -1.299 . . . . 37.57 109.721 163.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 7' ' ' LEU . . . . . . . . . . . . . 65.3 tp -60.38 -47.2 87.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.275 -0.875 . . . . 50.219999999999999 110.517 -176.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 8' ' ' ARG . . . . . . . . . . . . . 29.2 ttp85 -46.74 -53.91 10.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.821 -0.627 . . . . 48.469999999999999 111.966 173.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.94 -30.18 65.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 117.674 -1.611 . . . . 40.240000000000002 111.137 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 10' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.75 -49.56 74.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 118.707 -1.197 . . . . 35.119999999999997 110.484 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 11' ' ' LEU . . . . . . . . . . . . . 38.0 mt -58.64 -39.57 80.93 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.25 -0.58 . . . . 42.100000000000001 110.63 -179.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -67.17 -41.81 85.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.382 -0.527 . . . . 38.100000000000001 110.958 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.98 89.38 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.116 -0.634 . . . . 38.93 110.031 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 14' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.25 -38.44 91.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.225 -0.443 . . . . 42.460000000000001 110.942 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -56.06 -46.57 78.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 51.039999999999999 110.429 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -78.34 -31.26 48.53 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.806 -1.157 . . . . 51.670000000000002 112.3 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.14 -51.92 67.7 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.918 -0.713 . . . . 48.299999999999997 110.162 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 18' ' ' ILE . . . . . . . . . . . . . 5.0 mm -46.5 -57.65 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 109.697 -0.482 . . . . 36.07 109.697 172.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 19' ' ' GLU . . . . . . . . . . . . . . . -46.74 -64.28 0.81 Allowed 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.487 0.715 . . . . 44.079999999999998 111.386 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.8 -13.41 61.68 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 115.893 -2.323 . . . . 53.119999999999997 112.413 -174.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' O' O ' 21' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.23 -46.46 83.72 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 119.072 -1.051 . . . . 53.960000000000001 109.764 165.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 22' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -81.38 46.49 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.0 -0.741 . . . . 55.960000000000001 109.0 -173.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 23' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -134.63 -22.52 1.67 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.952 -0.567 . . . . 63.859999999999999 112.462 157.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 24' ' ' TRP . . . . . . . . . . . . . . . -95.89 75.79 3.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.366 1.079 . . . . 66.739999999999995 108.355 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.95 54.1 37.77 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.327 -1.109 . . . . 77.390000000000001 110.327 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' O' O ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.106 . . . . 71.939999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 1' ' ' SER . . . . . 0.549 ' OG ' ' NZ ' ' N' ' 23' ' ' LYS . 1.4 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.36 0.6 . . . . 63.969999999999999 110.341 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -74.96 -5.52 44.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 79.569999999999993 112.385 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 3' ' ' LEU . . . . . . . . . . . . . 5.1 mp -53.7 -40.19 65.82 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 120.746 0.307 . . . . 67.849999999999994 110.578 169.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -52.67 63.8 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.75 -0.38 . . . . 71.049999999999997 111.007 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.51 -39.43 83.84 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.763 -0.775 . . . . 63.030000000000001 110.599 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 6' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.51 -42.67 92.75 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.582 -0.847 . . . . 59.740000000000002 110.511 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 7' ' ' LEU . . . . . . . . . . . . . . . -63.63 -44.1 94.89 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 120.939 0.399 . . . . 58.450000000000003 110.709 179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 8' ' ' ARG . . . . . . . . . . . . . . . -53.24 -45.05 68.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.141 0.496 . . . . 63.729999999999997 110.301 175.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 9' ' ' LYS . . . . . . . . . . . . . 4.9 mtmt -60.53 -49.4 77.71 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.169 0.509 . . . . 92.670000000000002 111.135 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 10' ' ' LEU . . . . . . . . . . . . . 4.5 mt -53.6 -49.87 66.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 119.735 -0.786 . . . . 67.159999999999997 109.835 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 tp -61.56 -37.9 85.53 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 119.797 -0.761 . . . . 64.040000000000006 110.548 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 12' ' ' GLU . . . . . . . . . . . . . . . -57.46 -60.31 3.85 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 119.673 -0.811 . . . . 67.900000000000006 110.076 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.25 -34.51 32.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.152 -0.476 . . . . 72.870000000000005 110.296 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 14' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -64.37 -48.13 76.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.082 -0.508 . . . . 64.709999999999994 110.764 177.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 15' ' ' HIS . . . . . . . . . . . . . . . -57.26 -41.2 79.21 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.531 -0.468 . . . . 61.140000000000001 110.642 178.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 16' ' ' LYS . . . . . . . . . . . . . . . -64.59 -46.6 82.0 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.2 0.524 . . . . 52.590000000000003 110.75 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.25 -55.73 5.56 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.835 -0.746 . . . . 59.719999999999999 110.223 168.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 18' ' ' ILE . . . . . . . . . . . . . 14.8 mt -58.97 -35.9 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.188 0.518 . . . . 82.120000000000005 110.515 -174.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 19' ' ' GLU . . . . . . . . . . . . . . . -60.74 -43.78 97.5 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.947 -0.701 . . . . 54.450000000000003 110.08 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.51 -45.9 90.38 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 118.847 -1.141 . . . . 66.909999999999997 109.985 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -50.35 -35.96 30.13 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.219 0.533 . . . . 80.079999999999998 111.213 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.81 -55.51 5.42 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.327 0.584 . . . . 73.980000000000004 110.392 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.42 -23.96 64.69 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.774 -0.771 . . . . 70.260000000000005 111.655 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 24' ' ' TRP . . . . . . . . . . . . . 2.1 m95 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 118.075 0.398 . . . . 74.489999999999995 110.842 -174.377 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Q' Q ' 1' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 109.266 -0.642 . . . . 58.840000000000003 109.266 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Q' Q ' 2' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -51.42 -28.76 13.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.507 -0.77 . . . . 56.439999999999998 110.777 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 3' ' ' LEU . . . . . . . . . . . . . 40.7 tp -61.44 -52.02 66.31 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.293 0.568 . . . . 40.159999999999997 111.403 172.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 4' ' ' LEU . . . . . . . . . . . . . 3.4 mt -61.32 -40.91 95.95 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.545 -0.862 . . . . 55.68 110.808 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 5' ' ' GLU . . . . . . . . . . . . . . . -53.12 -48.29 67.99 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.125 0.488 . . . . 44.75 111.487 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 6' ' ' LEU . . . . . . . . . . . . . 1.9 pp -67.95 -35.37 78.29 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 117.695 -1.602 . . . . 47.68 111.108 -178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -53.54 -43.15 68.16 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.88 -1.128 . . . . 35.939999999999998 109.864 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 8' ' ' ARG . . . . . 0.441 ' NH2' ' O ' ' Q' ' 202' ' ' HOH . 8.6 mtm-85 -59.26 -54.4 47.31 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.149 -0.478 . . . . 54.149999999999999 111.113 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Q' Q ' 9' ' ' LYS . . . . . . . . . . . . . 26.2 mmtt -62.86 -33.88 76.2 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 117.907 -1.517 . . . . 41.75 110.328 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 10' ' ' LEU . . . . . . . . . . . . . 15.2 tp -59.18 -43.2 92.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 119.494 -0.882 . . . . 44.259999999999998 110.634 172.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mt -69.94 -40.91 75.19 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.065 -1.054 . . . . 35.710000000000001 110.91 -173.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -62.98 -34.89 78.49 Favored 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 119.574 -0.851 . . . . 63.700000000000003 110.072 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.87 -50.68 65.63 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.012 -0.675 . . . . 46.450000000000003 110.678 175.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -56.38 -40.62 74.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.334 0.588 . . . . 44.840000000000003 110.086 179.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 15' ' ' HIS . . . . . . . . . . . . . 20.5 t-80 -69.56 -31.87 70.31 Favored 'General case' 0 N--CA 1.44 -0.925 0 C-N-CA 119.479 -0.888 . . . . 47.960000000000001 110.924 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -75.35 -27.46 59.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 117.662 -1.615 . . . . 48.200000000000003 111.32 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.52 -41.74 88.35 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 119.309 -0.956 . . . . 46.439999999999998 110.477 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 18' ' ' ILE . . . . . . . . . . . . . 45.3 mt -47.05 -57.16 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.587 0.708 . . . . 41.07 109.501 170.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -61.26 -30.82 70.7 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.012 -0.54 . . . . 66.579999999999998 112.053 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 20' ' ' LEU . . . . . . . . . . . . . 10.9 mt -70.35 -37.25 74.6 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.457 -0.897 . . . . 51.350000000000001 111.114 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 tp -63.55 -42.36 98.39 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.346 -0.942 . . . . 70.010000000000005 110.627 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -58.67 -37.66 76.5 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.784 -0.766 . . . . 51.530000000000001 111.208 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 23' ' ' LYS . . . . . . . . . . . . . 8.4 ttpt -77.53 -64.81 1.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 118.995 -1.082 . . . . 64.969999999999999 111.242 179.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 24' ' ' TRP . . . . . . . . . . . . . 28.1 m0 -86.31 48.33 1.6 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.386 -0.526 . . . . 80.549999999999997 110.956 -178.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.69 -81.04 0.63 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.445 -0.407 . . . . 65.150000000000006 112.319 173.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.068 . . . . 62.619999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' R' R ' 1' ' ' SER . . . . . 0.403 ' OG ' ' N ' ' R' ' 2' ' ' LYS . 4.6 t . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.219 0.533 . . . . 68.049999999999997 111.972 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 2' ' ' LYS . . . . . 0.403 ' N ' ' OG ' ' R' ' 1' ' ' SER . 8.5 mmtm -70.89 2.52 4.21 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.73 1.011 . . . . 63.270000000000003 113.73 -169.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' R' R ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.55 -26.96 67.29 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.269 -0.972 . . . . 54.689999999999998 111.098 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.94 -39.9 55.15 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 119.09 -1.044 . . . . 65.75 111.086 -179.067 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' R' R ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.02 -42.48 76.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.406 -0.918 . . . . 65.129999999999995 110.283 167.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.57 -47.52 81.86 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.202 0.525 . . . . 52.090000000000003 111.383 177.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 7' ' ' LEU . . . . . 0.607 ' O ' ' CD1' ' R' ' 11' ' ' LEU . . . -60.96 -50.56 72.91 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.975 0.416 . . . . 53.68 110.747 -178.508 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' R' R ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.7 -38.12 53.7 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 120.402 -0.519 . . . . 86.980000000000004 111.04 175.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 9' ' ' LYS . . . . . . . . . . . . . . . -61.31 -54.42 44.16 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 120.365 -0.534 . . . . 77.430000000000007 110.693 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 10' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -55.5 -35.08 65.21 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 118.716 -1.194 . . . . 50.240000000000002 110.474 177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 11' ' ' LEU . . . . . 0.607 ' CD1' ' O ' ' R' ' 7' ' ' LEU . 1.0 OUTLIER -65.54 -53.62 39.54 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.184 -0.606 . . . . 45.93 110.976 -173.494 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' R' R ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -67.39 -29.36 68.85 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 118.591 -1.244 . . . . 80.609999999999999 110.29 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.43 80.66 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.962 -1.095 . . . . 57.090000000000003 110.714 173.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -69.45 -46.6 66.33 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 120.896 0.379 . . . . 49.770000000000003 110.984 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 15' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.71 -44.64 6.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.35 -0.611 . . . . 69.310000000000002 109.35 168.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 16' ' ' LYS . . . . . . . . . . . . . . . -66.58 -47.97 71.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.902 0.382 . . . . 45.32 111.439 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.78 -39.58 74.33 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.42 -0.912 . . . . 62.130000000000003 110.855 175.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 18' ' ' ILE . . . . . . . . . . . . . . . -64.62 -51.2 70.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.202 0.525 . . . . 53.240000000000002 110.217 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 19' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -57.1 -29.51 63.58 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.541 -0.3 . . . . 87.010000000000005 110.58 176.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -62.68 -57.37 11.27 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.214 -0.594 . . . . 62.899999999999999 109.954 172.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 mt -47.28 -32.16 4.41 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.129 -0.487 . . . . 80.739999999999995 111.29 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.73 -64.66 0.95 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.553 -0.459 . . . . 78.260000000000005 111.278 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.0 -58.79 3.95 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.955 0.407 . . . . 91.370000000000005 110.956 -169.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 24' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -83.59 54.81 2.97 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.93 -1.507 . . . . 87.579999999999998 106.93 172.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 25' ' ' GLY . . . . . . . . . . . . . . . -150.03 140.72 8.22 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.602 -1.799 . . . . 64.689999999999998 108.602 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' R' R ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.053 -0.073 . . . . 57.310000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' S' S ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.507 -0.68 0 N-CA-C 107.965 -1.124 . . . . 63.530000000000001 107.965 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' S' S ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.55 -45.51 85.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.014 -1.448 . . . . 57.979999999999997 111.089 -176.404 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' S' S ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.88 -38.55 76.42 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 119.896 -0.722 . . . . 46.520000000000003 112.061 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 4' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.27 -36.45 83.72 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 119.283 -0.967 . . . . 42.399999999999999 110.36 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.61 -37.68 87.23 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.76 -0.776 . . . . 38.960000000000001 110.94 173.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 6' ' ' LEU . . . . . . . . . . . . . 3.6 tt -59.51 -55.37 35.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.63 0.729 . . . . 43.840000000000003 110.453 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 7' ' ' LEU . . . . . . . . . . . . . 24.7 tp -55.2 -37.34 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 42.899999999999999 110.156 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 8' ' ' ARG . . . . . 0.494 ' NH2' ' O ' ' S' ' 101' ' ' HOH . 38.9 ttp180 -60.27 -57.48 12.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.135 1.161 . . . . 52.280000000000001 114.135 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' S' S ' 9' ' ' LYS . . . . . . . . . . . . . 11.3 mmtt -69.4 -28.09 65.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.809 -0.757 . . . . 48.630000000000003 111.085 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 10' ' ' LEU . . . . . . . . . . . . . 4.9 tp -65.75 -45.93 80.76 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 119.625 -0.83 . . . . 47.93 110.724 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 11' ' ' LEU . . . . . . . . . . . . . 6.1 mt -59.13 -43.92 92.0 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 120.094 -0.642 . . . . 47.140000000000001 110.568 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 12' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.84 -42.98 94.79 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.87 -0.732 . . . . 52.649999999999999 110.233 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.27 93.86 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.028 -0.669 . . . . 53.469999999999999 110.255 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 14' ' ' LEU . . . . . . . . . . . . . 1.3 tt -63.25 -42.3 99.18 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.59 -0.444 . . . . 43.789999999999999 110.964 -179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 15' ' ' HIS . . . . . 0.44 ' NE2' ' OE2' ' S' ' 19' ' ' GLU . 18.0 t60 -59.95 -40.05 87.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.952 0.406 . . . . 58.939999999999998 110.226 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' S' S ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.69 -33.38 74.8 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.997 -1.081 . . . . 74.689999999999998 111.253 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.96 98.05 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.718 -0.793 . . . . 45.840000000000003 110.703 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 18' ' ' ILE . . . . . . . . . . . . . 24.0 mt -53.88 -51.31 46.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 109.634 -0.506 . . . . 53.640000000000001 109.634 175.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 19' ' ' GLU . . . . . 0.44 ' OE2' ' NE2' ' S' ' 15' ' ' HIS . 21.3 mt-10 -57.4 -42.83 83.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.973 -1.091 . . . . 64.260000000000005 111.4 -179.145 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 7.5 mt -69.66 -46.75 65.4 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.132 -1.027 . . . . 57.350000000000001 110.81 -174.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 tp -51.63 -48.48 63.29 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.201 0.524 . . . . 66.079999999999998 110.495 174.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 22' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -65.43 -45.27 84.52 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 119.385 -0.926 . . . . 75.769999999999996 110.764 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -76.41 -64.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 118.632 -1.227 . . . . 57.549999999999997 111.769 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 24' ' ' TRP . . . . . . . . . . . . . 13.5 m0 . . . . . 0 C--N 1.323 -0.571 0 C-N-CA 119.478 -0.889 . . . . 66.969999999999999 109.699 -176.792 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' T' T ' 1' ' ' SER . . . . . 0.423 ' OG ' ' N ' ' T' ' 2' ' ' LYS . 18.9 t . . . . . 0 C--O 1.236 0.362 0 CA-C-O 121.034 0.445 . . . . 63.240000000000002 111.013 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 2' ' ' LYS . . . . . 0.423 ' N ' ' OG ' ' T' ' 1' ' ' SER . . . -78.32 -4.73 49.5 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.025 0.75 . . . . 61.890000000000001 113.025 -177.002 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' T' T ' 3' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.7 -39.18 76.6 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 119.982 -0.687 . . . . 61.479999999999997 110.597 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 4' ' ' LEU . . . . . . . . . . . . . 22.2 tp -65.78 -42.9 90.2 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.744 -1.182 . . . . 77.829999999999998 110.701 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.69 -43.62 97.5 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.508 -0.877 . . . . 71.409999999999997 110.486 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 6' ' ' LEU . . . . . . . . . . . . . 6.7 tp -62.29 -40.16 95.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.126 0.489 . . . . 53.380000000000003 111.146 179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -61.41 -51.4 68.93 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.412 -0.358 . . . . 70.129999999999995 110.48 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.61 -36.06 44.25 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.6 -0.44 . . . . 77.0 110.524 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 9' ' ' LYS . . . . . . . . . . . . . . . -65.53 -52.84 49.63 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.061 0.458 . . . . 86.430000000000007 111.041 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 10' ' ' LEU . . . . . . . . . . . . . 2.5 mt -52.7 -40.51 63.05 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.776 -0.77 . . . . 72.890000000000001 109.804 176.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tp -65.88 -49.22 68.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.021 -0.536 . . . . 52.969999999999999 110.535 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.51 -40.2 95.19 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.473 -0.491 . . . . 63.030000000000001 110.79 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -38.5 70.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.566 -0.854 . . . . 61.43 110.328 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 14' ' ' LEU . . . . . . . . . . . . . 2.2 tt -67.06 -43.83 81.67 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.739 -0.384 . . . . 71.439999999999998 111.252 179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -53.2 -45.4 68.59 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.505 -0.878 . . . . 78.680000000000007 109.737 174.112 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' T' T ' 16' ' ' LYS . . . . . . . . . . . . . 3.2 mptt -59.02 -45.84 89.7 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.276 0.56 . . . . 80.0 110.474 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.52 81.29 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.154 -0.618 . . . . 69.5 110.999 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 18' ' ' ILE . . . . . . . . . . . . . 3.7 mm -69.05 -35.89 71.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 C-N-CA 118.699 -1.2 . . . . 67.060000000000002 110.649 -174.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 19' ' ' GLU . . . . . . . . . . . . . . . -57.95 -49.66 76.03 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.653 -0.419 . . . . 57.439999999999998 110.901 174.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 20' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.72 82.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.603 -0.839 . . . . 77.150000000000006 110.707 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 21' ' ' LEU . . . . . . . . . . . . . . . -52.12 -42.17 63.1 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.735 0.302 . . . . 91.019999999999996 110.458 173.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 22' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -57.97 -22.35 48.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.81 0.67 . . . . 94.310000000000002 112.81 -178.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -115.83 14.56 16.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.292 0.849 . . . . 78.359999999999999 113.292 -162.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 24' ' ' TRP . . . . . 0.434 ' O ' ' O ' ' T' ' 101' ' ' HOH . 0.3 OUTLIER -155.8 101.54 2.14 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.54 -0.911 . . . . 92.859999999999999 108.54 172.971 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' T' T ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.98 39.51 0.04 OUTLIER Glycine 0 C--N 1.332 0.351 0 O-C-N 123.717 0.636 . . . . 109.18000000000001 114.087 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 O-C-N 122.862 -0.199 . . . . 106.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' U' U ' 1' ' ' SER . . . . . 0.417 ' O ' ' OE2' ' U' ' 5' ' ' GLU . 6.4 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.863 0.839 . . . . 46.399999999999999 109.747 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 2' ' ' LYS . . . . . 0.719 ' NZ ' ' O ' ' U' ' 101' ' ' HOH . 2.3 mppt? -87.68 22.23 2.33 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.298 -0.865 . . . . 47.340000000000003 113.061 -167.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' U' U ' 3' ' ' LEU . . . . . 0.604 ' N ' ' O ' ' U' ' 102' ' ' HOH . 4.8 tp -122.61 -49.43 2.01 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 121.962 -0.461 . . . . 34.159999999999997 111.768 166.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' U' U ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.81 -33.6 73.25 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 119.291 -0.964 . . . . 44.390000000000001 110.382 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 5' ' ' GLU . . . . . 0.417 ' OE2' ' O ' ' U' ' 1' ' ' SER . 0.5 OUTLIER -70.6 -33.84 71.49 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 118.79 -1.164 . . . . 46.109999999999999 110.878 175.531 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' U' U ' 6' ' ' LEU . . . . . . . . . . . . . 3.9 tp -56.06 -49.49 73.61 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.613 0.721 . . . . 48.780000000000001 110.468 168.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 7' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.09 -39.97 72.94 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.353 -0.839 . . . . 42.68 110.415 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 ttp85 -60.78 -55.38 33.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.134 -0.485 . . . . 47.530000000000001 110.942 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 9' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -64.43 -31.14 72.23 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.996 -1.482 . . . . 57.630000000000003 111.187 -176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 10' ' ' LEU . . . . . . . . . . . . . 44.7 tp -63.13 -52.1 63.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.723 -1.191 . . . . 39.700000000000003 111.393 171.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.32 -39.33 66.93 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.931 0.396 . . . . 37.619999999999997 110.889 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 12' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' U' ' 15' ' ' HIS . 14.6 mt-10 -59.08 -61.01 2.96 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.207 -0.597 . . . . 62.32 109.725 175.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' U' U ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.46 -42.53 3.31 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.212 0.529 . . . . 48.469999999999999 110.278 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 14' ' ' LEU . . . . . 0.437 ' CD2' ' O ' ' S' ' 101' ' ' HOH . 0.6 OUTLIER -63.0 -46.91 85.43 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.663 -0.699 . . . . 51.609999999999999 110.978 177.429 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' U' U ' 15' ' ' HIS . . . . . 0.403 ' N ' ' O ' ' U' ' 12' ' ' GLU . 1.7 t60 -51.38 -45.53 62.48 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.561 0.696 . . . . 75.219999999999999 111.199 176.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' U' U ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.06 -23.97 38.15 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 119.539 -0.864 . . . . 64.409999999999997 112.462 -174.346 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' U' U ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -45.82 92.55 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.23 -0.588 . . . . 46.649999999999999 110.475 167.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 18' ' ' ILE . . . . . . . . . . . . . 68.1 mt -51.45 -61.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.67 -0.493 . . . . 56.810000000000002 109.67 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 19' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -45.87 -39.05 8.06 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.996 0.427 . . . . 63.170000000000002 112.044 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 mt -71.23 -36.63 71.89 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.79 -0.764 . . . . 52.049999999999997 111.127 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 tp -63.23 -41.09 99.07 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.931 -0.708 . . . . 65.180000000000007 110.796 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -56.39 -62.99 1.34 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.191 -0.459 . . . . 46.25 110.777 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -54.38 -61.1 2.53 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.22 -0.592 . . . . 68.349999999999994 111.047 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 24' ' ' TRP . . . . . . . . . . . . . 43.8 m95 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.41 0.624 . . . . 83.390000000000001 111.108 179.174 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 1' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.38 0.61 . . . . 61.280000000000001 110.092 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 2' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.55 -45.83 57.21 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.496 -1.229 . . . . 82.430000000000007 110.267 173.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' V' V ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 tp -68.3 -34.1 75.54 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.441 -0.345 . . . . 69.939999999999998 111.066 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mt -59.03 -52.23 66.65 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.137 -1.025 . . . . 81.900000000000006 110.476 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.66 -38.6 91.72 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 119.56 -0.856 . . . . 57.030000000000001 111.259 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 6' ' ' LEU . . . . . . . . . . . . . 8.4 tp -54.22 -51.23 65.1 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.342 0.591 . . . . 59.170000000000002 110.397 176.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 7' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -55.82 -41.27 73.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.873 -0.603 . . . . 67.319999999999993 110.666 176.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' V' V ' 8' ' ' ARG . . . . . . . . . . . . . . . -57.46 -58.87 6.38 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.679 0.752 . . . . 60.57 110.885 -178.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -69.73 -21.79 63.44 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.307 -1.357 . . . . 64.680000000000007 111.391 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 10' ' ' LEU . . . . . . . . . . . . . 5.6 mt -59.02 -51.83 68.36 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.185 0.517 . . . . 51.75 110.819 168.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -50.78 -42.65 58.07 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.141 -0.482 . . . . 66.409999999999997 110.778 172.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' V' V ' 12' ' ' GLU . . . . . . . . . . . . . . . -57.84 -56.99 14.82 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.974 -0.69 . . . . 69.489999999999995 110.644 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 13' ' ' ALA . . . . . . . . . . . . . . . -50.02 -40.14 43.76 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.041 0.448 . . . . 57.549999999999997 110.554 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 14' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -57.65 -57.76 11.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.295 0.569 . . . . 78.480000000000004 110.801 179.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 15' ' ' HIS . . . . . . . . . . . . . . . -54.26 -35.42 62.5 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.484 -0.486 . . . . 101.20999999999999 111.353 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 16' ' ' LYS . . . . . . . . . . . . . 7.8 mttt -64.6 -48.56 74.46 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.773 -0.771 . . . . 112.47 111.177 179.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.66 -42.69 71.65 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.858 -0.737 . . . . 62.100000000000001 110.689 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 18' ' ' ILE . . . . . . . . . . . . . 2.6 mt -62.03 -44.38 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.243 0.544 . . . . 62.189999999999998 110.328 -179.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.2 -47.25 78.72 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.954 0.407 . . . . 76.650000000000006 110.785 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 20' ' ' LEU . . . . . . . . . . . . . 9.6 mt -61.64 -46.06 91.4 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.809 -0.756 . . . . 78.239999999999995 110.715 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 21' ' ' LEU . . . . . . . . . . . . . 2.9 tt -51.2 -52.66 42.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.315 0.579 . . . . 84.150000000000006 110.973 175.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 22' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -67.03 -38.55 86.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.104 -0.638 . . . . 82.450000000000003 111.255 -173.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -65.06 -38.56 91.2 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.322 -0.551 . . . . 97.140000000000001 110.996 -179.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' V' V ' 24' ' ' TRP . . . . . . . . . . . . . 64.4 m95 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.255 -0.578 . . . . 69.620000000000005 110.832 175.88 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' W' W ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 121.334 0.588 . . . . 56.479999999999997 110.871 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' W' W ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -68.69 -25.45 64.8 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.901 -0.59 . . . . 50.420000000000002 111.958 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 3' ' ' LEU . . . . . . . . . . . . . 13.8 tp -65.76 -43.08 89.96 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.576 -0.449 . . . . 55.700000000000003 111.578 170.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mt -66.1 -38.27 87.83 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.949 -0.469 . . . . 56.119999999999997 111.165 177.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.04 -40.31 95.3 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.423 -0.511 . . . . 45.979999999999997 111.202 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.72 -52.37 65.42 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.389 -0.524 . . . . 41.289999999999999 111.195 174.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.22 -42.3 69.67 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.776 -0.769 . . . . 38.380000000000003 110.227 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -55.68 -62.06 1.94 Allowed 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.39 0.676 . . . . 50.460000000000001 111.464 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 mttp -69.17 -24.13 64.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 118.243 -1.383 . . . . 74.010000000000005 112.021 -174.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 10' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.76 -48.16 78.08 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.738 -0.785 . . . . 44.770000000000003 110.369 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 11' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.7 -37.21 85.58 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 119.328 -0.949 . . . . 36.789999999999999 111.033 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.29 -43.57 94.34 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.784 -1.167 . . . . 55.649999999999999 110.362 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.23 -45.43 72.3 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.28 0.562 . . . . 42.659999999999997 110.356 173.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tt -65.09 -40.74 95.02 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.075 -0.65 . . . . 60.079999999999998 110.852 -178.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 15' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -54.81 -39.1 68.14 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 120.888 0.375 . . . . 36.460000000000001 111.177 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -84.39 -28.45 26.93 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.505 -1.678 . . . . 66.349999999999994 111.472 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.45 -40.5 87.04 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 119.611 -0.836 . . . . 48.799999999999997 110.419 168.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 18' ' ' ILE . . . . . . . . . . . . . 6.4 mt -60.59 -63.06 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.145 -0.479 . . . . 63.770000000000003 109.84 177.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 19' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -42.68 -34.68 0.94 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.903 0.382 . . . . 65.0 111.428 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 20' ' ' LEU . . . . . . . . . . . . . 4.4 mt -66.91 -56.02 12.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.457 -0.897 . . . . 55.640000000000001 110.659 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.81 -19.53 62.67 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 116.096 -2.242 . . . . 59.25 111.436 -173.778 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' W' W ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.57 -3.17 13.73 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.565 0.58 . . . . 56.960000000000001 112.565 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -130.03 -38.12 1.45 Allowed 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 118.061 -1.456 . . . . 56.380000000000003 112.697 156.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' W' W ' 24' ' ' TRP . . . . . . . . . . . . . 18.1 m95 . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.704 0.631 . . . . 60.32 112.704 -173.654 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 1' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.798 0.333 . . . . 67.439999999999998 111.212 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . . . -125.01 -39.71 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 58.920000000000002 111.155 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 3' ' ' LEU . . . . . . . . . . . . . 1.1 tt -60.64 -47.98 83.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 61.600000000000001 111.213 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 4' ' ' LEU . . . . . . . . . . . . . 4.2 mp -58.5 -47.66 83.37 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 123.197 1.475 . . . . 80.799999999999997 109.528 -179.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . . . -54.87 -44.47 74.07 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.975 -1.466 . . . . 86.079999999999998 110.677 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 6' ' ' LEU . . . . . . . . . . . . . 4.3 tt -52.15 -47.28 65.51 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.704 0.764 . . . . 66.349999999999994 110.594 177.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 7' ' ' LEU . . . . . . . . . . . . . 3.4 mt -64.84 -48.86 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.682 -0.69 . . . . 74.650000000000006 110.898 -175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 8' ' ' ARG . . . . . . . . . . . . . . . -59.79 -34.0 72.46 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.173 -1.011 . . . . 56.299999999999997 110.886 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . . . -60.54 -50.04 75.12 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.983 -0.687 . . . . 55.079999999999998 110.268 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 10' ' ' LEU . . . . . . . . . . . . . 24.5 mt -62.15 -31.37 71.84 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 118.698 -1.201 . . . . 62.32 111.099 178.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.3 -37.34 68.98 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.818 -1.153 . . . . 73.129999999999995 111.067 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.7 -41.14 63.02 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 118.837 -1.145 . . . . 100.26000000000001 110.553 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.21 -37.24 66.87 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.166 -0.614 . . . . 67.359999999999999 110.441 170.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.65 -36.91 79.19 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.39 0.276 . . . . 61.909999999999997 110.963 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 15' ' ' HIS . . . . . 0.54 ' NE2' ' OE2' ' X' ' 19' ' ' GLU . 22.9 t-160 -58.16 -53.15 61.55 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.764 0.792 . . . . 73.519999999999996 110.333 175.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 16' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -59.35 -39.03 81.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.664 -0.698 . . . . 76.310000000000002 110.966 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.12 91.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.947 0.403 . . . . 90.379999999999995 111.002 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 18' ' ' ILE . . . . . . . . . . . . . . . -61.54 -42.73 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.198 0.523 . . . . 74.989999999999995 109.783 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 19' ' ' GLU . . . . . 0.54 ' OE2' ' NE2' ' X' ' 15' ' ' HIS . 23.7 mt-10 -63.87 -48.84 75.08 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.512 -0.875 . . . . 83.930000000000007 110.962 -176.986 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' X' X ' 20' ' ' LEU . . . . . . . . . . . . . . . -68.92 -26.77 65.25 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 120.2 -0.6 . . . . 66.349999999999994 111.857 -178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 21' ' ' LEU . . . . . . . . . . . . . 2.5 tt -75.21 -42.73 54.87 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.493 -0.883 . . . . 88.480000000000004 110.966 178.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 22' ' ' GLU . . . . . . . . . . . . . . . -62.04 -41.57 98.26 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.17 -0.612 . . . . 112.84999999999999 110.86 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.59 -61.61 1.95 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.183 -0.607 . . . . 107.34999999999999 111.615 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' X' X ' 24' ' ' TRP . . . . . . . . . . . . . 5.3 m95 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.571 -0.529 . . . . 123.59 109.571 173.831 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Y' Y ' 1' ' ' SER . . . . . 0.48 ' O ' ' OG ' ' Y' ' 1' ' ' SER . 1.5 t . . . . . 0 CA--C 1.514 -0.441 0 CA-C-O 120.841 0.353 . . . . 60.310000000000002 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -120.93 -49.11 2.22 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 115.75 -0.659 . . . . 73.129999999999995 112.423 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 3' ' ' LEU . . . . . . . . . . . . . 17.9 tp -58.92 -27.83 65.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 118.919 -1.112 . . . . 58.469999999999999 110.767 169.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 4' ' ' LEU . . . . . . . . . . . . . 3.7 mp -48.54 -45.07 36.97 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.222 -0.591 . . . . 52.689999999999998 110.517 168.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 5' ' ' GLU . . . . . . . . . . . . . . . -74.91 -34.87 62.21 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 119.893 -0.723 . . . . 50.170000000000002 111.823 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 6' ' ' LEU . . . . . . . . . . . . . 2.3 tp -50.99 -56.24 13.45 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.333 -0.947 . . . . 43.899999999999999 108.973 170.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 7' ' ' LEU . . . . . . . . . . . . . 53.2 tp -43.32 -61.18 1.42 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.931 1.292 . . . . 39.039999999999999 111.038 174.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 8' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' Y' ' 11' ' ' LEU . . . -56.37 -66.75 0.38 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.709 -0.678 . . . . 62.689999999999998 111.657 -173.467 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Y' Y ' 9' ' ' LYS . . . . . 0.731 ' NZ ' ' OE2' ' A' ' 12' ' ' GLU . 38.7 mttt -54.36 -28.63 44.28 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.453 -1.299 . . . . 48.43 110.487 -175.624 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Y' Y ' 10' ' ' LEU . . . . . . . . . . . . . 28.7 tp -62.01 -46.17 90.4 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.797 -0.761 . . . . 48.530000000000001 110.55 170.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 11' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' Y' ' 8' ' ' ARG . 36.0 mt -60.89 -46.56 90.14 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.134 0.492 . . . . 38.719999999999999 110.428 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Y' Y ' 12' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -55.04 -43.82 74.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 116.17 -0.468 . . . . 52.390000000000001 110.291 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.17 99.54 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.183 -0.607 . . . . 60.200000000000003 110.306 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 14' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.05 -48.46 78.49 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.364 0.602 . . . . 58.700000000000003 109.843 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 15' ' ' HIS . . . . . 0.607 ' ND1' ' O ' ' Y' ' 101' ' ' HOH . 2.4 t60 -63.53 -29.43 70.69 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.059 -0.657 . . . . 61.789999999999999 110.673 -177.297 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Y' Y ' 16' ' ' LYS . . . . . . . . . . . . . 5.7 mttt -78.42 -31.6 48.26 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.252 -0.979 . . . . 74.430000000000007 111.843 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.58 -45.58 88.74 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 119.491 -0.884 . . . . 60.159999999999997 109.909 167.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 18' ' ' ILE . . . . . . . . . . . . . 13.5 mt -55.76 -47.12 79.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.762 -0.653 . . . . 49.450000000000003 110.455 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 19' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -64.97 -37.45 87.69 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.097 -0.641 . . . . 91.430000000000007 111.097 -175.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mt -62.58 -43.0 99.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 119.187 -1.005 . . . . 51.439999999999998 109.686 175.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 21' ' ' LEU . . . . . . . . . . . . . 10.6 mt -55.93 -38.89 70.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.644 -0.422 . . . . 69.409999999999997 111.093 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 22' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -69.52 -55.23 10.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.358 -0.537 . . . . 60.259999999999998 110.956 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 23' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -55.28 -31.01 61.26 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.389 -0.524 . . . . 70.890000000000001 111.645 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 24' ' ' TRP . . . . . . . . . . . . . 7.5 m95 . . . . . 0 C--N 1.327 -0.383 0 C-N-CA 120.422 -0.511 . . . . 88.579999999999998 111.1 172.62 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 1' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.44 -0.578 . . . . 69.359999999999999 109.44 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 2' ' ' LYS . . . . . . . . . . . . . . . -52.45 -25.55 10.38 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.535 -0.757 . . . . 69.810000000000002 111.316 169.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 3' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' Z' ' 103' ' ' HOH . 1.2 tt -59.64 -51.09 71.31 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.133 0.492 . . . . 76.219999999999999 110.848 170.426 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Z' Z ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 tp -63.28 -39.13 93.72 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 119.386 -0.926 . . . . 76.959999999999994 110.682 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.25 -46.67 79.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 119.866 -0.734 . . . . 65.739999999999995 110.281 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 tt -49.47 -56.26 10.38 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.323 0.582 . . . . 68.519999999999996 110.721 175.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 tt -68.04 -34.51 76.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 66.569999999999993 111.2 -171.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.35 -47.93 83.61 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.149 -0.62 . . . . 65.560000000000002 110.588 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 9' ' ' LYS . . . . . 0.644 ' NZ ' ' O ' ' Z' ' 102' ' ' HOH . 63.3 mmtt -65.02 -37.0 86.18 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.061 -1.055 . . . . 65.799999999999997 110.405 -178.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Z' Z ' 10' ' ' LEU . . . . . . . . . . . . . . . -63.01 -35.2 79.41 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.409 -0.517 . . . . 60.439999999999998 110.734 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.37 -41.2 85.48 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.334 -0.546 . . . . 71.129999999999995 111.442 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.99 -46.51 88.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.146 -1.022 . . . . 89.700000000000003 109.989 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.62 -33.71 66.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.09 -0.381 . . . . 61.119999999999997 111.234 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 14' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.63 -60.93 2.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.202 0.525 . . . . 62.219999999999999 110.183 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 15' ' ' HIS . . . . . . . . . . . . . . . -47.02 -40.31 14.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.972 -0.558 . . . . 83.969999999999999 111.395 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 16' ' ' LYS . . . . . 0.695 ' O ' ' CD1' ' Z' ' 20' ' ' LEU . . . -54.13 -60.71 2.98 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.089 0.471 . . . . 74.849999999999994 110.326 175.032 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Z' Z ' 17' ' ' ALA . . . . . . . . . . . . . . . -49.53 -46.6 48.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.953 -0.567 . . . . 48.640000000000001 110.945 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 18' ' ' ILE . . . . . . . . . . . . . 1.5 mp -61.34 -39.93 84.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 119.745 -0.782 . . . . 60.75 109.899 -176.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 19' ' ' GLU . . . . . . . . . . . . . . . -62.01 -47.49 84.52 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 119.962 -0.695 . . . . 67.030000000000001 110.497 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 20' ' ' LEU . . . . . 0.695 ' CD1' ' O ' ' Z' ' 16' ' ' LYS . 4.0 mp -55.58 -38.97 70.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.865 -0.734 . . . . 72.739999999999995 110.091 178.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' Z' Z ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.24 -50.75 70.49 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.84 -0.744 . . . . 72.010000000000005 110.366 176.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 22' ' ' GLU . . . . . . . . . . . . . . . -51.36 -38.44 53.26 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.994 0.426 . . . . 80.069999999999993 110.764 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 23' ' ' LYS . . . . . . . . . . . . . . . -70.78 -60.73 2.08 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.64 -0.824 . . . . 77.719999999999999 111.112 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 24' ' ' TRP . . . . . . . . . . . . . . . -70.06 110.84 5.33 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.097 -0.377 . . . . 70.920000000000002 110.781 -162.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.46 0 CA-C-N 116.076 -0.511 . . . . 72.409999999999997 112.258 172.18 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 1' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.222 0.534 . . . . 86.760000000000005 109.885 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 2' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -68.55 -44.3 74.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.516 -0.765 . . . . 75.129999999999995 111.254 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 3' ' ' LEU . . . . . . . . . . . . . . . -62.38 -37.8 87.13 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.31 -0.956 . . . . 49.899999999999999 110.638 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.8 -48.28 79.78 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.993 -0.683 . . . . 47.380000000000003 110.717 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.23 -34.01 75.68 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.531 -0.868 . . . . 52.939999999999998 111.21 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 6' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.92 -40.08 94.23 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 119.479 -0.888 . . . . 51.200000000000003 110.705 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 7' ' ' LEU . . . . . . . . . . . . . 5.1 mt -63.03 -44.87 94.71 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 119.512 -0.875 . . . . 57.350000000000001 110.306 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 8' ' ' ARG . . . . . . . . . . . . . . . -49.06 -46.0 43.82 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.442 0.639 . . . . 48.460000000000001 110.296 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 9' ' ' LYS . . . . . . . . . . . . . . . -69.05 -47.2 65.96 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.515 -0.874 . . . . 62.170000000000002 111.28 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 10' ' ' LEU . . . . . . . . . . . . . 12.5 mt -50.62 -52.46 39.21 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.646 0.736 . . . . 46.43 110.129 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -57.14 -61.56 2.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.964 -0.562 . . . . 41.439999999999998 110.686 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 12' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -46.93 -47.38 21.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.043 0.449 . . . . 81.859999999999999 110.995 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.79 -44.82 66.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.961 0.41 . . . . 39.909999999999997 111.169 170.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 14' ' ' LEU . . . . . . . . . . . . . 9.2 tp -65.63 -60.42 2.94 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.805 -0.758 . . . . 66.280000000000001 110.804 -175.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 15' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -39.1 -39.32 0.56 Allowed 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 125.456 1.502 . . . . 49.789999999999999 110.151 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -70.11 -45.92 65.9 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.954 0.407 . . . . 67.519999999999996 111.094 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 -39.68 61.81 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.576 -0.45 . . . . 59.079999999999998 110.568 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.55 -67.37 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.332 -1.729 . . . . 61.020000000000003 106.332 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -41.05 -50.98 3.39 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.961 0.726 . . . . 74.019999999999996 112.961 -176.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.11 -58.66 7.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.583 -0.847 . . . . 67.560000000000002 110.943 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.81 -42.13 88.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.241 -0.584 . . . . 58.920000000000002 111.149 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 22' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -53.24 -49.85 66.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.549 -0.296 . . . . 73.689999999999998 110.357 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -63.57 -24.06 67.65 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.433 -1.307 . . . . 65.150000000000006 112.116 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' a' a ' 24' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 C--N 1.325 -0.462 0 C-N-CA 120.409 -0.516 . . . . 93.579999999999998 111.255 -178.739 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.83 0.348 . . . . 71.540000000000006 110.5 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 3' ' ' LEU . . . . . . . . . . . . . 7.4 mp -62.24 -50.33 72.16 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.987 -0.685 . . . . 66.069999999999993 110.671 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.67 -27.32 58.26 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.425 -0.91 . . . . 65.120000000000005 112.011 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.79 -45.23 93.63 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.23 -0.988 . . . . 82.390000000000001 109.956 171.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tt -50.92 -48.63 60.63 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.3 0.571 . . . . 80.450000000000003 110.622 171.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 7' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.22 -51.99 67.11 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.178 -0.465 . . . . 69.959999999999994 111.487 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 8' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -49.16 -55.87 11.0 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.562 0.696 . . . . 94.870000000000005 110.547 179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 9' ' ' LYS . . . . . . . . . . . . . . . -62.74 -38.52 90.84 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.639 -0.71 . . . . 130.09 111.382 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.63 -45.65 89.26 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.124 -1.03 . . . . 95.489999999999995 110.518 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.05 -41.21 99.43 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 119.162 -1.015 . . . . 58.640000000000001 110.541 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 12' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -55.26 -63.26 1.22 Allowed 'General case' 0 C--O 1.244 0.771 0 C-N-CA 120.51 -0.476 . . . . 79.5 109.957 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.17 15.82 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.236 -0.438 . . . . 75.25 111.715 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.01 -52.04 47.45 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.117 -0.633 . . . . 62.890000000000001 111.091 -176.464 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' b' b ' 15' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -60.19 -38.83 84.46 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 118.179 -1.408 . . . . 74.900000000000006 110.707 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 16' ' ' LYS . . . . . . . . . . . . . . . -51.29 -52.19 47.45 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.218 0.532 . . . . 93.230000000000004 110.796 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.25 94.16 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 116.136 -0.484 . . . . 86.530000000000001 111.669 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 mt -63.23 -48.81 85.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 119.019 -1.072 . . . . 71.299999999999997 110.08 -173.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.38 -25.34 65.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 117.672 -1.611 . . . . 99.579999999999998 111.543 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mt -63.48 -47.4 81.94 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.154 -1.019 . . . . 84.239999999999995 110.79 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 tt -72.58 -35.16 67.87 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 115.789 -2.364 . . . . 114.11 110.418 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 22' ' ' GLU . . . . . . . . . . . . . . . -43.09 -44.17 4.77 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.114 -0.698 . . . . 89.319999999999993 109.114 173.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . . . -61.75 -69.01 0.27 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.716 -0.674 . . . . 77.060000000000002 110.378 165.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' b' b ' 24' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.47 0.527 0 O-C-N 121.746 -0.597 . . . . 79.739999999999995 111.835 -171.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 1' ' ' SER . . . . . . . . . . . . . 9.9 t . . . . . 0 C--O 1.218 -0.559 0 N-CA-C 111.464 0.172 . . . . 57.75 111.464 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 2' ' ' LYS . . . . . . . . . . . . . . . -59.83 -43.21 94.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.238 0.459 . . . . 57.700000000000003 112.238 -168.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 tp -61.71 -45.29 94.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 118.958 -1.097 . . . . 54.850000000000001 110.66 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 4' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.18 -37.14 71.7 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.07 -0.652 . . . . 44.299999999999997 110.741 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.13 -48.54 81.16 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.238 0.542 . . . . 54.57 110.15 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 tp -48.32 -58.76 4.13 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.695 0.759 . . . . 48.630000000000003 110.419 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 7' ' ' LEU . . . . . . . . . . . . . 6.9 tp -51.4 -63.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.101 -0.954 . . . . 39.609999999999999 110.213 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -47.56 -45.84 27.4 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.707 -0.679 . . . . 75.280000000000001 111.221 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 9' ' ' LYS . . . . . . . . . . . . . 25.4 mmtt -69.42 -32.45 71.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 117.995 -1.482 . . . . 54.920000000000002 110.224 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 tp -62.64 -42.43 99.59 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.319 -0.952 . . . . 53.350000000000001 111.081 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 11' ' ' LEU . . . . . . . . . . . . . 11.8 mt -68.79 -50.16 52.57 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.865 0.364 . . . . 38.649999999999999 111.102 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 12' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -55.64 -36.5 67.09 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.029 -1.068 . . . . 48.530000000000001 110.178 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.23 -44.43 83.82 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 120.123 -0.631 . . . . 61.25 110.696 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -49.55 -54.5 17.72 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.219 0.533 . . . . 53.539999999999999 109.894 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -72.38 -25.29 61.45 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.441 -0.904 . . . . 72.75 111.653 -172.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -72.56 -38.83 67.84 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.159 -1.016 . . . . 50.869999999999997 110.585 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.32 -41.51 93.65 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.551 -0.46 . . . . 62.789999999999999 110.77 170.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 18' ' ' ILE . . . . . . . . . . . . . 66.5 mt -58.96 -53.3 49.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.406 0.622 . . . . 62.5 110.187 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . . . -57.72 -34.23 69.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.381 -0.372 . . . . 53.009999999999998 111.635 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.32 -45.3 63.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.209 -0.996 . . . . 48.880000000000003 111.225 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 21' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.04 -31.02 72.06 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.232 -0.987 . . . . 68.359999999999999 110.944 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 22' ' ' GLU . . . . . . . . . . . . . . . -52.14 -22.18 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.151 -0.619 . . . . 56.479999999999997 111.804 174.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.152 0.501 . . . . 61.759999999999998 110.898 172.434 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' d' d ' 1' ' ' SER . . . . . . . . . . . . . 37.1 t . . . . . 0 CA--C 1.518 -0.276 0 CA-C-O 122.153 0.978 . . . . 68.189999999999998 109.08 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' d' d ' 2' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -56.02 -64.38 0.88 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-N 113.815 -1.538 . . . . 67.5 110.822 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 tp -63.05 -30.63 71.75 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.497 -0.481 . . . . 71.390000000000001 111.609 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 mp -57.17 -52.0 67.05 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.234 0.54 . . . . 74.599999999999994 110.764 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.02 -37.3 83.91 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.321 -0.4 . . . . 71.129999999999995 111.104 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 6' ' ' LEU . . . . . . . . . . . . . 5.5 tt -54.96 -50.49 68.79 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.98 -0.688 . . . . 86.849999999999994 110.799 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.61 -40.52 88.86 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.62 -0.432 . . . . 91.739999999999995 110.91 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 8' ' ' ARG . . . . . . . . . . . . . . . -56.32 -51.69 67.29 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 119.33 -0.948 . . . . 105.39 110.596 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -63.06 -45.44 92.18 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.736 -0.786 . . . . 83.590000000000003 110.853 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 tt -59.57 -38.32 80.82 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.117 0.484 . . . . 65.379999999999995 110.763 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 11' ' ' LEU . . . . . . . . . . . . . . . -63.39 -48.82 76.29 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 120.664 -0.414 . . . . 76.25 110.477 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -67.61 -31.23 71.11 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 116.998 -1.881 . . . . 102.70999999999999 111.418 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.02 -50.24 74.16 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.813 -0.755 . . . . 65.379999999999995 110.577 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 14' ' ' LEU . . . . . . . . . . . . . . . -55.75 -38.62 70.07 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.731 -0.388 . . . . 85.799999999999997 111.272 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 15' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.45 -53.51 57.56 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.31 -0.556 . . . . 124.70999999999999 110.691 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 16' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -69.77 -26.97 64.55 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.421 -1.311 . . . . 77.049999999999997 111.236 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.8 -51.98 66.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.549 -0.861 . . . . 51.409999999999997 110.929 173.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 18' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.87 -29.1 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.552 -0.459 . . . . 75.25 109.985 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.69 -52.04 67.19 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.61 -0.836 . . . . 86.590000000000003 110.482 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' d' d ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -39.86 89.64 Favored 'General case' 0 C--O 1.192 -1.95 0 C-N-CA 118.302 -1.359 . . . . 58.659999999999997 111.221 177.633 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' d' d ' 21' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.86 -66.1 0.59 Allowed 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 117.374 -1.73 . . . . 76.930000000000007 107.952 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 22' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -41.74 -38.67 1.51 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.741 0.817 . . . . 101.54000000000001 110.656 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 23' ' ' LYS . . . . . . . . . . . . . . . -58.67 -58.64 7.67 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.592 -0.443 . . . . 93.599999999999994 111.057 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 24' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -70.33 -9.16 55.35 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.801 -0.76 . . . . 126.53 112.914 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 25' ' ' GLY . . . . . . . . . . . . . . . 131.19 78.39 0.17 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 118.48 0.582 . . . . 104.03 112.847 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' d' d ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 O-C-N 122.952 -0.146 . . . . 55.450000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.712 0.291 . . . . 56.810000000000002 111.51 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.74 -34.91 70.02 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.605 -0.838 . . . . 64.060000000000002 110.802 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -43.31 93.32 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.926 -0.31 . . . . 79.269999999999996 111.588 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' e' e ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 mt -73.98 -39.81 63.42 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.894 -0.723 . . . . 58.909999999999997 111.554 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.02 -45.75 89.92 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.602 -0.839 . . . . 56.479999999999997 109.984 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 6' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.75 -42.6 99.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.592 -0.443 . . . . 63.270000000000003 110.928 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -61.05 -55.12 36.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 119.985 -0.686 . . . . 55.759999999999998 109.923 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.67 -46.44 1.84 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 123.993 0.917 . . . . 51.560000000000002 110.871 171.625 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' e' e ' 9' ' ' LYS . . . . . . . . . . . . . . . -70.85 -46.73 62.17 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 119.736 -0.785 . . . . 76.439999999999998 111.423 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 10' ' ' LEU . . . . . . . . . . . . . . . -56.01 -43.5 77.77 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.445 -0.902 . . . . 71.510000000000005 109.657 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mt -61.31 -41.14 96.51 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 120.861 -0.335 . . . . 60.07 111.288 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.01 -48.95 61.75 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.447 -0.901 . . . . 62.770000000000003 110.948 -173.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.62 -28.74 70.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 118.252 -1.379 . . . . 54.020000000000003 110.427 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -53.63 56.22 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.147 -0.621 . . . . 62.189999999999998 110.962 171.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' e' e ' 15' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -37.03 67.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 120.376 -0.53 . . . . 70.590000000000003 110.229 179.898 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' e' e ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.92 -27.41 39.89 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 113.883 -3.127 . . . . 65.590000000000003 110.942 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.85 69.03 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.559 0.695 . . . . 69.060000000000002 109.498 168.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 18' ' ' ILE . . . . . . . . . . . . . 10.2 mt -58.78 -66.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.772 -0.649 . . . . 63.719999999999999 109.414 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 19' ' ' GLU . . . . . . . . . . . . . . . -55.16 -35.6 64.94 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 120.649 -0.42 . . . . 51.07 110.922 -172.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.38 -33.46 75.25 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.946 -0.702 . . . . 73.780000000000001 110.834 175.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.92 -56.99 8.94 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.902 -1.119 . . . . 78.810000000000002 110.25 175.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.92 -21.34 7.67 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.343 0.497 . . . . 64.170000000000002 112.343 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 23' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -81.72 -65.9 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 119.665 -0.814 . . . . 56.789999999999999 110.494 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' e' e ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.318 0 C-N-CA 123.819 0.848 . . . . 68.030000000000001 112.613 -171.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 mmtt . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.091 -0.707 . . . . 95.260000000000005 109.091 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' f' f ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.8 -32.88 60.79 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.503 -0.771 . . . . 91.5 110.631 169.819 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' f' f ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 tt -58.95 -65.38 0.67 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.168 0.587 . . . . 109.15000000000001 111.255 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 5' ' ' GLU . . . . . . . . . . . . . . . -57.94 -28.66 64.5 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.14 -0.624 . . . . 92.659999999999997 111.287 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -59.6 -54.99 40.14 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.864 -0.734 . . . . 78.609999999999999 110.623 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 7' ' ' LEU . . . . . . . . . . . . . . . -51.42 -41.2 60.62 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.18 -0.608 . . . . 81.159999999999997 110.309 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 8' ' ' ARG . . . . . . . . . . . . . . . -60.1 -54.57 44.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.345 0.593 . . . . 80.890000000000001 110.736 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 9' ' ' LYS . . . . . . . . . . . . . . . -55.99 -37.22 68.8 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.317 -0.553 . . . . 88.049999999999997 110.581 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 10' ' ' LEU . . . . . . . . . . . . . . . -59.36 -44.78 92.66 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.3 -0.96 . . . . 89.599999999999994 110.513 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mt -61.88 -39.66 92.72 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 119.781 -0.767 . . . . 78.239999999999995 110.511 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 12' ' ' GLU . . . . . . . . . . . . . . . -58.93 -55.34 36.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.107 -0.637 . . . . 74.0 110.003 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.73 64.66 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.7 -0.682 . . . . 85.790000000000006 111.052 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tp -67.6 -39.6 84.77 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.845 -0.742 . . . . 75.859999999999999 110.751 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.83 -44.64 86.57 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.006 -1.078 . . . . 77.760000000000005 110.056 174.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -58.67 -38.89 79.15 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.601 -0.44 . . . . 79.879999999999995 111.216 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.99 -48.5 73.76 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.318 -0.553 . . . . 75.129999999999995 111.214 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 pt -64.38 -31.07 52.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 C-N-CA 118.717 -1.193 . . . . 80.579999999999998 109.831 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -44.11 94.0 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.957 0.408 . . . . 87.430000000000007 110.688 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 20' ' ' LEU . . . . . . . . . . . . . 11.0 mt -62.65 -31.8 72.73 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.236 -0.986 . . . . 93.230000000000004 110.901 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.1 -40.55 59.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.388 -0.525 . . . . 113.58 111.78 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.2 16.59 0.43 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.686 0.625 . . . . 85.609999999999999 112.686 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -78.52 -34.65 47.12 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.77 0.656 . . . . 89.810000000000002 112.77 -173.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' f' f ' 24' ' ' TRP . . . . . . . . . . . . . 15.3 m95 . . . . . 0 C--N 1.326 -0.452 0 O-C-N 121.997 -0.44 . . . . 125.95999999999999 111.131 -174.65 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MPD . . . . . 0.531 ' O2 ' ' NH2' ' A' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 101' ' ' PO4 . . . . . 0.508 ' O3 ' ' NH2' ' E' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' I' I ' 101' ' ' PO4 . . . . . 0.481 ' O4 ' ' NH1' ' I' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 101' ' ' PO4 . . . . . 0.532 ' O3 ' ' NZ ' ' M' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 101' ' ' CO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' HOH . . . . . 0.622 ' O ' ' NH1' ' C' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' HOH . . . . . 0.707 ' O ' ' NZ ' ' D' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 101' ' ' HOH . . . . . 0.718 ' O ' ' ND1' ' F' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' F' F ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 101' ' ' HOH . . . . . 0.459 ' O ' ' O ' ' G' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' G' G ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' G' G ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 102' ' ' HOH . . . . . 0.477 ' O ' ' N ' ' H' ' 1' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' H' H ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' H' H ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' J' J ' 101' ' ' HOH . . . . . 0.579 ' O ' ' NE1' ' J' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' K' K ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' K' K ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 101' ' ' HOH . . . . . 0.736 ' O ' ' NZ ' ' L' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 103' ' ' HOH . . . . . 0.565 ' O ' ' NZ ' ' L' ' 16' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' L' L ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' L' L ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' M' M ' 201' ' ' HOH . . . . . 0.68 ' O ' ' NH1' ' M' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 202' ' ' HOH . . . . . 0.645 ' O ' ' N ' ' M' ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 203' ' ' HOH . . . . . 0.555 ' O ' ' N ' ' M' ' 1' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' M' M ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' M' M ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' M' M ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' M' M ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' O' O ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Q' Q ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Q' Q ' 202' ' ' HOH . . . . . 0.441 ' O ' ' NH2' ' Q' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Q' Q ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Q' Q ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' R' R ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' R' R ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' R' R ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' S' S ' 101' ' ' HOH . . . . . 0.494 ' O ' ' NH2' ' S' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' S' S ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' S' S ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' S' S ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' T' T ' 101' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' T' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' T' T ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' U' U ' 101' ' ' HOH . . . . . 0.719 ' O ' ' NZ ' ' U' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 102' ' ' HOH . . . . . 0.604 ' O ' ' N ' ' U' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' U' U ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' V' V ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' W' W ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' W' W ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' W' W ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Y' Y ' 101' ' ' HOH . . . . . 0.607 ' O ' ' ND1' ' Y' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Y' Y ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Y' Y ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Y' Y ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Y' Y ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 102' ' ' HOH . . . . . 0.644 ' O ' ' NZ ' ' Z' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 103' ' ' HOH . . . . . 0.575 ' O ' ' N ' ' Z' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' Z' Z ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' Z' Z ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' a' a ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' b' b ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' c' c ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' d' d ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' e' e ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' f' f ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' f' f ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' f' f ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . 0.476 ' C ' HD23 ' A' ' 3' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.871 0.367 . . . . 63.299999999999997 110.548 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . 0.585 ' HB3' HD11 ' C' ' 20' ' ' LEU . 0.3 OUTLIER -51.01 -39.65 56.29 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.029 -0.987 . . . . 76.200000000000003 111.159 -174.527 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD23 ' C ' ' A' ' 1' ' ' SER . 1.7 pt? -42.21 -48.77 4.94 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.396 0.887 . . . . 99.579999999999998 113.396 178.693 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . 0.724 ' HA ' HD12 ' A' ' 7' ' ' LEU . 24.0 mt -118.2 -20.41 8.61 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 114.329 1.233 . . . . 73.730000000000004 114.329 -167.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . . . -48.24 -46.04 35.04 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 118.587 -1.245 . . . . 63.5 108.779 153.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' Y' ' 16' ' ' LYS . 8.3 tp -51.57 -49.36 62.23 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.449 -0.796 . . . . 57.969999999999999 111.309 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -75.12 -39.5 60.54 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 118.312 -1.355 . . . . 79.420000000000002 113.63 -177.434 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . 0.531 ' NH2' ' O2 ' ' A' ' 101' ' ' MPD . 4.4 ttt-85 -47.46 -49.93 24.28 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 117.669 -1.612 . . . . 219.37 109.411 176.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -65.86 -46.21 79.3 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.634 -0.826 . . . . 329.97000000000003 111.626 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 26.5 tp -59.68 -48.01 83.35 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.731 -0.787 . . . . 213.71000000000001 111.12 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 14' ' ' LEU . 3.8 mt -60.46 -39.64 88.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.236 -0.585 . . . . 71.540000000000006 111.683 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . 0.628 ' OE2' ' NZ ' ' Y' ' 9' ' ' LYS . 16.8 mt-10 -65.73 -41.79 91.8 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.189 -1.004 . . . . 63.950000000000003 110.259 178.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HB2' ' HB2' ' C' ' 9' ' ' LYS . . . -50.3 -45.21 54.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.095 -1.042 . . . . 61.700000000000003 109.33 170.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.635 HD23 ' O ' ' C' ' 101' ' ' HOH . 3.2 tp -64.69 -39.35 93.51 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.81 -0.756 . . . . 59.329999999999998 111.696 179.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.642 ' NE2' ' OE2' ' A' ' 19' ' ' GLU . 15.1 t-160 -55.81 -49.83 72.15 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 109.175 -0.676 . . . . 56.170000000000002 109.175 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -71.22 -22.71 61.97 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.542 -0.863 . . . . 78.450000000000003 110.948 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 20' ' ' LEU . . . -67.81 -41.59 82.89 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.691 -0.404 . . . . 58.009999999999998 110.528 174.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.1 mt -57.55 -48.31 83.35 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.396 0.617 . . . . 56.950000000000003 110.059 169.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . 0.642 ' OE2' ' NE2' ' A' ' 15' ' ' HIS . 52.8 mt-10 -58.88 -46.56 87.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.152 0.501 . . . . 57.280000000000001 110.904 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 17' ' ' ALA . . . -70.78 -39.61 73.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.585 -0.279 . . . . 67.620000000000005 110.805 -178.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tt -50.56 -56.23 12.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.464 0.649 . . . . 79.670000000000002 110.281 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -62.28 -46.75 87.41 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.943 -0.572 . . . . 72.5 110.986 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -61.91 -63.77 1.15 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.243 -0.583 . . . . 70.200000000000003 110.901 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TRP . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' LEU . 2.9 m95 -85.01 50.25 1.9 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.871 0.843 . . . . 76.109999999999999 111.061 175.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.5 86.76 0.36 Allowed Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.493 -1.043 . . . . 66.489999999999995 110.493 167.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.967 -0.117 . . . . 61.689999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 CA--C 1.524 -0.056 0 CA-C-O 120.885 0.374 . . . . 80.969999999999999 111.252 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' LYS . . . . . 0.404 ' C ' HD21 ' Z' ' 20' ' ' LEU . . . 55.33 31.27 16.38 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.737 -0.665 . . . . 98.010000000000005 111.777 -177.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.82 13.89 1.23 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.639 0.607 . . . . 93.739999999999995 112.639 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' B' ' 7' ' ' LEU . . . -118.93 -44.48 2.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 123.392 0.677 . . . . 83.409999999999997 112.434 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . . . -50.49 -17.99 0.58 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 113.024 0.75 . . . . 80.730000000000004 113.024 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' B' ' 10' ' ' LEU . . . -51.13 -37.28 45.17 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 120.115 -0.634 . . . . 73.920000000000002 110.387 165.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LEU . . . . . 0.615 ' HA ' HD11 ' A' ' 14' ' ' LEU . 1.5 tm? -52.22 -48.38 65.16 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.019 -0.673 . . . . 62.520000000000003 109.853 171.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.3 -40.86 95.73 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.752 -0.779 . . . . 67.560000000000002 110.884 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -67.32 -48.3 67.99 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.13 -0.628 . . . . 71.030000000000001 110.867 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 6' ' ' LEU . . . -63.63 -28.82 70.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.076 -0.65 . . . . 82.379999999999995 110.935 174.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.13 -48.58 67.63 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 120.409 -0.516 . . . . 75.170000000000002 110.303 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . . . -65.87 -41.46 91.58 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.223 -0.591 . . . . 83.439999999999998 110.876 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.04 -44.08 30.78 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.239 -0.584 . . . . 80.0 110.83 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' LEU . . . . . 0.425 ' HA ' HD23 ' B' ' 14' ' ' LEU . 1.8 tt -72.12 -40.35 68.2 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 111.896 0.332 . . . . 80.019999999999996 111.896 -177.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' HIS . . . . . 0.694 ' HA ' HD12 ' B' ' 18' ' ' ILE . 6.6 t-160 -49.55 -50.68 41.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.107 0.479 . . . . 72.569999999999993 110.152 172.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' B' ' 16' ' ' LYS . 49.5 mmtt -68.67 -39.08 80.77 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.304 -0.407 . . . . 75.189999999999998 111.825 -176.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -43.44 78.92 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.05 -0.66 . . . . 89.299999999999997 111.488 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ILE . . . . . 0.761 HG21 HD22 ' D' ' 21' ' ' LEU . 9.7 mm -68.03 -33.72 62.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 119.784 -0.766 . . . . 94.299999999999997 109.972 176.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' B' ' 15' ' ' HIS . 8.5 mt-10 -53.39 -53.84 45.36 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.905 0.384 . . . . 81.090000000000003 110.969 171.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' B' ' 102' ' ' HOH . . . -62.3 -48.6 79.16 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.27 -0.572 . . . . 79.379999999999995 111.426 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LEU . . . . . 0.504 HD23 ' O ' ' B' ' 21' ' ' LEU . . . -57.43 -55.73 31.07 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.976 0.417 . . . . 81.040000000000006 111.08 -176.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . . . -66.87 -19.67 65.78 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.015 -0.674 . . . . 94.170000000000002 112.235 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . . . -72.2 -50.34 28.37 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.511 0.596 . . . . 83.819999999999993 110.794 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' TRP . . . . . 0.409 ' CE3' ' HA ' ' B' ' 24' ' ' TRP . 12.0 m95 . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 118.979 -1.088 . . . . 99.170000000000002 109.741 174.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 1' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.513 -0.451 0 CA-C-O 122.085 0.945 . . . . 63.670000000000002 110.434 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.07 -29.48 65.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.246 -1.343 . . . . 57.979999999999997 112.204 -161.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' C' ' 6' ' ' LEU . 7.0 tp -69.85 -40.48 75.78 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.911 -1.516 . . . . 59.920000000000002 111.15 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 mt -63.73 -38.27 90.47 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.668 -0.813 . . . . 47.140000000000001 110.799 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' C' ' 9' ' ' LYS . . . -63.72 -44.12 94.53 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.025 -0.67 . . . . 52.700000000000003 110.774 173.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' LEU . . . . . 0.418 ' HB3' ' O ' ' C' ' 3' ' ' LEU . 1.9 tm? -48.84 -49.32 39.79 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.616 0.722 . . . . 52.090000000000003 109.977 172.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 7' ' ' LEU . . . . . 0.434 HD11 HD13 ' D' ' 18' ' ' ILE . 8.5 tp -54.17 -50.4 67.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.242 -0.89 . . . . 58.329999999999998 110.643 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ARG . . . . . 0.622 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 8.0 ttp85 -59.59 -46.58 88.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.505 -0.478 . . . . 51.719999999999999 111.605 -176.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' LYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 13' ' ' ALA . 12.5 mmmt -66.37 -38.65 88.05 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 118.417 -1.313 . . . . 41.990000000000002 110.28 -178.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' D' ' 14' ' ' LEU . 3.2 tp -50.56 -48.41 57.47 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.095 0.474 . . . . 55.18 110.804 168.207 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 11' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' E' ' 4' ' ' LEU . 4.9 mt -71.74 -48.39 47.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.732 -0.387 . . . . 43.340000000000003 111.121 -169.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' C' ' 8' ' ' ARG . 16.3 mt-10 -61.8 -31.74 71.98 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.413 -0.915 . . . . 45.490000000000002 110.29 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.13 -47.5 85.66 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.774 -0.77 . . . . 49.75 110.274 171.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' LEU . . . . . 0.624 ' HG ' HD22 ' D' ' 10' ' ' LEU . 2.1 tp -53.05 -46.93 68.75 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.278 0.561 . . . . 53.57 110.926 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 15' ' ' HIS . . . . . 0.588 ' HA ' HD12 ' C' ' 18' ' ' ILE . . . -77.12 -36.63 55.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.145 -0.48 . . . . 63.960000000000001 111.588 -171.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mmtt -73.32 -14.82 61.37 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.603 -0.839 . . . . 57.390000000000001 111.558 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.08 -46.63 17.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.961 0.41 . . . . 55.560000000000002 110.914 168.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ILE . . . . . 0.588 HD12 ' HA ' ' C' ' 15' ' ' HIS . 42.7 mt -57.58 -39.91 72.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.467 -0.493 . . . . 53.240000000000002 110.426 175.293 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.35 -63.89 0.84 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.172 0.51 . . . . 73.189999999999998 111.144 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' LEU . . . . . 1.061 ' O ' ' HB2' ' C' ' 24' ' ' TRP . 1.0 OUTLIER -67.72 -30.51 70.02 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.995 -0.682 . . . . 77.519999999999996 111.494 -177.428 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LEU . . . . . 0.514 ' HB2' HD22 ' D' ' 3' ' ' LEU . 12.5 tp -58.86 -41.57 87.35 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.195 -1.002 . . . . 59.0 110.548 177.327 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -55.15 -63.09 1.27 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.934 0.397 . . . . 72.340000000000003 110.805 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 mmmm -79.82 19.04 0.71 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.634 0.605 . . . . 70.099999999999994 112.634 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' TRP . . . . . 1.061 ' HB2' ' O ' ' C' ' 20' ' ' LEU . 80.2 m95 . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 112.827 0.677 . . . . 99.370000000000005 112.827 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 1' ' ' SER . . . . . 0.528 ' N ' HD12 ' D' ' 4' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 121.295 0.569 . . . . 71.730000000000004 111.688 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 2' ' ' LYS . . . . . 0.781 ' HB2' HD21 ' F' ' 20' ' ' LEU . 7.5 mtmt -56.61 -67.86 0.27 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.788 -1.096 . . . . 86.230000000000004 111.339 -166.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 3' ' ' LEU . . . . . 0.514 HD22 ' HB2' ' C' ' 21' ' ' LEU . 5.3 tt -67.38 -25.01 65.75 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.088 -1.045 . . . . 86.640000000000001 111.274 178.389 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 4' ' ' LEU . . . . . 0.528 HD12 ' N ' ' D' ' 1' ' ' SER . 2.1 mt -60.83 -59.78 4.84 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.274 -0.571 . . . . 66.769999999999996 110.404 -174.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 5' ' ' GLU . . . . . . . . . . . . . . . -52.99 -36.68 60.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.196 0.522 . . . . 68.629999999999995 110.811 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tt -58.23 -56.24 24.62 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.36 0.6 . . . . 87.069999999999993 110.909 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' D' ' 11' ' ' LEU . 1.8 mt -57.46 -37.35 72.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.576 -0.85 . . . . 71.390000000000001 110.658 178.36 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 8' ' ' ARG . . . . . 0.503 ' HA ' HD12 ' D' ' 11' ' ' LEU . . . -56.16 -61.62 2.26 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.345 -0.542 . . . . 62.920000000000002 110.65 179.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' D' ' 9' ' ' LYS . 26.2 mmtt -59.89 -32.92 71.19 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.01 -1.076 . . . . 69.269999999999996 110.811 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 10' ' ' LEU . . . . . 0.624 HD22 ' HG ' ' C' ' 14' ' ' LEU . 3.7 mt -54.72 -40.99 69.81 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.009 -0.677 . . . . 71.099999999999994 110.789 171.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' D' ' 8' ' ' ARG . 7.9 mt -69.09 -40.49 78.37 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 120.198 -0.601 . . . . 63.560000000000002 111.227 -179.731 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' GLU . . . . . 0.448 ' OE2' ' NZ ' ' D' ' 9' ' ' LYS . 2.2 tt0 -57.29 -43.67 83.4 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 119.711 -0.796 . . . . 76.890000000000001 109.808 175.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.54 79.79 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.45 -0.341 . . . . 62.219999999999999 111.033 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' LEU . . . . . 0.922 ' O ' HD12 ' D' ' 18' ' ' ILE . 59.8 tp -56.78 -64.44 0.87 Allowed 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.581 -0.848 . . . . 65.219999999999999 109.892 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 15' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -53.12 -30.29 35.83 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.177 -1.009 . . . . 97.819999999999993 111.296 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.02 -61.13 2.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.514 -0.874 . . . . 69.560000000000002 110.986 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' D' ' 20' ' ' LEU . . . -60.43 -30.26 69.51 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.188 -1.005 . . . . 62.520000000000003 111.123 -178.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 18' ' ' ILE . . . . . 0.922 HD12 ' O ' ' D' ' 14' ' ' LEU . 45.1 mm -57.14 -43.88 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.297 0.57 . . . . 65.780000000000001 109.572 174.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.13 0.49 . . . . 69.829999999999998 110.511 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' LEU . . . . . 0.771 HD11 HD12 ' F' ' 6' ' ' LEU . 15.7 mt -42.84 -57.8 2.64 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.291 0.567 . . . . 56.710000000000001 109.686 175.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LEU . . . . . 0.761 HD22 HG21 ' B' ' 18' ' ' ILE . 2.7 tt -57.47 -67.1 0.36 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.057 -0.52 . . . . 86.120000000000005 110.692 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 22' ' ' GLU . . . . . 0.681 ' HG3' HG22 ' B' ' 18' ' ' ILE . 2.2 tm-20 -46.66 -24.92 0.62 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.022 -0.535 . . . . 94.590000000000003 112.112 -168.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 23' ' ' LYS . . . . . . . . . . . . . . . -50.93 -59.1 4.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.128 0.489 . . . . 79.180000000000007 111.19 170.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' D' ' 21' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 O-C-N 122.13 -0.356 . . . . 87.780000000000001 110.854 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 1' ' ' SER . . . . . 0.743 ' OG ' ' N ' ' E' ' 2' ' ' LYS . 1.2 t . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 55.350000000000001 109.126 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 2' ' ' LYS . . . . . 0.743 ' N ' ' OG ' ' E' ' 1' ' ' SER . 19.7 mttt 65.77 -8.59 0.3 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.934 0.716 . . . . 46.759999999999998 112.934 162.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 3' ' ' LEU . . . . . 0.705 HD23 ' H ' ' E' ' 3' ' ' LEU . 10.2 tp -119.67 -34.48 3.76 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.585 -0.697 . . . . 50.409999999999997 112.808 171.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 4' ' ' LEU . . . . . 0.545 ' HB3' HD21 ' C' ' 11' ' ' LEU . 9.7 mt -53.95 -33.6 57.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 118.909 -1.116 . . . . 53.229999999999997 109.478 161.876 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 5' ' ' GLU . . . . . . . . . . . . . . . -58.07 -55.34 36.17 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.994 0.426 . . . . 47.719999999999999 111.033 172.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 6' ' ' LEU . . . . . 0.643 ' HB3' HD12 ' E' ' 3' ' ' LEU . 6.1 tt -61.32 -52.12 65.99 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.009 -0.676 . . . . 55.740000000000002 110.792 -177.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 7' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' E' ' 11' ' ' LEU . 4.2 tp -44.35 -52.15 7.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 59.07 110.369 174.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 8' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' E' ' 4' ' ' LEU . 2.0 ttp85 -58.98 -45.45 90.55 Favored 'General case' 0 C--O 1.191 -1.998 0 N-CA-C 115.764 1.765 . . . . 59.75 115.764 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 9' ' ' LYS . . . . . 0.614 ' HG2' ' HD2' ' G' ' 9' ' ' LYS . 10.3 mttm -79.44 -31.24 42.49 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.616 -0.677 . . . . 47.340000000000003 112.003 -179.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.18 -46.95 79.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 119.76 -0.776 . . . . 39.869999999999997 110.14 169.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 11' ' ' LEU . . . . . 0.667 ' HA ' HD12 ' E' ' 14' ' ' LEU . 95.9 mt -63.08 -41.34 99.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.845 -0.742 . . . . 57.039999999999999 111.28 -178.302 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.99 -37.99 84.46 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.039 -1.064 . . . . 66.340000000000003 110.084 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 13' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' E' ' 102' ' ' HOH . . . -57.12 -47.31 81.42 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.109 0.48 . . . . 34.649999999999999 110.648 172.738 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 14' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' E' ' 11' ' ' LEU . 1.3 mt -54.16 -46.07 72.2 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.985 0.421 . . . . 58.280000000000001 111.522 175.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 15' ' ' HIS . . . . . 0.744 ' HA ' HD12 ' E' ' 18' ' ' ILE . 15.5 t-160 -65.49 -43.5 90.02 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.761 0.315 . . . . 45.409999999999997 111.073 -174.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 16' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' E' ' 20' ' ' LEU . 27.6 mmtt -70.42 -33.56 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.579 -1.248 . . . . 54.670000000000002 111.167 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.15 -47.07 82.08 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.133 -0.627 . . . . 62.439999999999998 110.267 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 18' ' ' ILE . . . . . 0.744 HD12 ' HA ' ' E' ' 15' ' ' HIS . 27.8 mt -52.32 -54.48 14.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 121.492 0.663 . . . . 56.420000000000002 109.853 176.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 19' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' E' ' 15' ' ' HIS . 53.8 mt-10 -59.35 -51.7 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.264 -0.574 . . . . 52.0 111.344 -173.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 20' ' ' LEU . . . . . 0.874 HD13 HD11 ' F' ' 3' ' ' LEU . 1.2 pp -69.54 -28.48 66.05 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.258 -1.377 . . . . 80.189999999999998 111.519 -175.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 21' ' ' LEU . . . . . 0.623 ' HB2' ' CD2' ' F' ' 3' ' ' LEU . 3.9 tp -57.25 -52.15 66.49 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 119.986 -0.685 . . . . 100.87 110.211 170.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' E' E ' 22' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.75 -32.48 63.85 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.29 -0.964 . . . . 105.44 112.149 -172.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 23' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -66.84 -61.72 1.81 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 120.634 -0.426 . . . . 81.299999999999997 111.237 -165.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 24' ' ' TRP . . . . . . . . . . . . . 13.6 p-90 -90.61 84.2 5.89 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 106.664 -1.606 . . . . 72.010000000000005 106.664 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 25' ' ' GLY . . . . . . . . . . . . . . . 140.21 -126.8 3.31 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.006 -1.238 . . . . 80.870000000000005 110.006 -171.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.822 0.311 . . . . 77.579999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.224 -0.237 0 CA-C-O 121.16 0.505 . . . . 70.0 110.45 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 2' ' ' LYS . . . . . . . . . . . . . . . -71.64 9.98 0.75 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 122.972 1.368 . . . . 68.569999999999993 112.641 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 3' ' ' LEU . . . . . 0.874 HD11 HD13 ' E' ' 20' ' ' LEU . 2.7 tt -61.44 -42.83 99.37 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.855 -1.066 . . . . 60.359999999999999 111.122 174.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.65 -41.15 89.92 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.956 -0.698 . . . . 84.189999999999998 110.241 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.49 -35.72 81.4 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.063 -0.655 . . . . 107.65000000000001 110.864 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 6' ' ' LEU . . . . . 0.771 HD12 HD11 ' D' ' 20' ' ' LEU . 7.9 tp -56.77 -43.2 80.59 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.375 0.607 . . . . 79.109999999999999 110.484 173.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 7' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' F' ' 11' ' ' LEU . 2.4 mt -63.69 -42.74 97.95 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.921 -0.712 . . . . 51.229999999999997 110.89 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 8' ' ' ARG . . . . . 0.659 ' HA ' HD12 ' F' ' 11' ' ' LEU . 40.7 ttt85 -59.27 -39.08 81.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.94 0.4 . . . . 78.0 111.157 178.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.74 -48.66 68.46 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.463 -0.495 . . . . 53.170000000000002 110.873 -179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 10' ' ' LEU . . . . . 0.528 ' HB3' ' HG ' ' E' ' 14' ' ' LEU . 7.9 mt -58.36 -34.52 70.76 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 118.461 -1.296 . . . . 59.109999999999999 110.687 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 11' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' F' ' 8' ' ' ARG . 2.4 mt -62.15 -62.28 1.88 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.552 -0.459 . . . . 56.079999999999998 110.866 176.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -50.12 -38.46 39.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.895 0.378 . . . . 87.709999999999994 110.788 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.47 85.33 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.45 -0.5 . . . . 54.07 111.145 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 14' ' ' LEU . . . . . 0.486 HD11 HD23 ' E' ' 11' ' ' LEU . 29.0 tp -64.39 -36.47 84.24 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 118.91 -1.116 . . . . 56.469999999999999 111.081 178.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 15' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -54.56 -52.68 61.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.864 -0.735 . . . . 65.909999999999997 110.247 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 16' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' H' ' 6' ' ' LEU . 8.6 mttt -61.27 -40.83 95.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.059 -0.519 . . . . 78.370000000000005 110.918 -178.251 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.1 79.36 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 120.07 -0.652 . . . . 54.920000000000002 110.985 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 18' ' ' ILE . . . . . 0.68 ' HA ' HD12 ' F' ' 21' ' ' LEU . . . -68.26 -49.84 63.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.653 0.739 . . . . 59.530000000000001 110.441 178.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.59 -34.46 67.2 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.161 -0.616 . . . . 70.150000000000006 110.911 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 20' ' ' LEU . . . . . 0.781 HD21 ' HB2' ' D' ' 2' ' ' LYS . . . -76.27 -36.6 58.34 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.261 -0.576 . . . . 62.740000000000002 111.826 179.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 21' ' ' LEU . . . . . 0.68 HD12 ' HA ' ' F' ' 18' ' ' ILE . 2.6 mt -51.62 -46.37 63.6 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.271 0.558 . . . . 70.719999999999999 109.902 170.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.51 -49.78 76.47 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.359 -0.536 . . . . 79.810000000000002 110.932 171.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 23' ' ' LYS . . . . . 0.543 ' HE2' ' HD3' ' D' ' 2' ' ' LYS . 54.6 tptt -57.38 -40.17 77.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.467 -0.333 . . . . 86.620000000000005 111.753 -168.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 24' ' ' TRP . . . . . 0.41 ' HA ' ' CE3' ' F' ' 24' ' ' TRP . 1.6 m95 -109.17 -53.6 2.63 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.246 0.832 . . . . 92.609999999999999 113.246 -176.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' F' F ' 25' ' ' GLY . . . . . . . . . . . . . . . -73.73 -91.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.866 -0.683 . . . . 90.25 113.105 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' F' F ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.051 . . . . 84.599999999999994 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 1' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' G' ' 5' ' ' GLU . 28.7 t . . . . . 0 C--O 1.237 0.406 0 CA-C-O 121.508 0.67 . . . . 59.689999999999998 109.55 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -60.65 -26.09 66.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.028 -0.987 . . . . 66.060000000000002 111.364 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 3' ' ' LEU . . . . . 0.656 HD12 ' H ' ' G' ' 3' ' ' LEU . 1.2 mp -59.85 -58.59 7.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.223 0.535 . . . . 65.099999999999994 110.822 174.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.96 -34.79 78.26 Favored 'General case' 0 CA--C 1.509 -0.608 0 C-N-CA 120.838 -0.345 . . . . 43.039999999999999 111.51 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 5' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' G' ' 1' ' ' SER . 1.8 mm-40 -73.26 -30.43 63.45 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 117.874 -1.531 . . . . 44.229999999999997 110.978 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 tp -56.07 -46.87 78.83 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.453 0.644 . . . . 49.07 110.042 165.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 7' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' G' ' 7' ' ' LEU . 0.0 OUTLIER -56.19 -39.8 72.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.864 -0.607 . . . . 45.670000000000002 110.796 176.565 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' G' G ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -60.63 -51.66 68.45 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.051 -0.522 . . . . 64.530000000000001 110.979 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 9' ' ' LYS . . . . . 0.614 ' HD2' ' HG2' ' E' ' 9' ' ' LYS . 32.5 mmtt -59.58 -38.67 81.81 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.319 -0.952 . . . . 34.75 110.036 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -55.86 -52.72 63.07 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.946 -0.702 . . . . 47.700000000000003 110.985 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 11' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' G' ' 11' ' ' LEU . 20.5 mt -65.34 -42.79 92.53 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.688 0.255 . . . . 36.25 111.688 -173.908 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -62.47 -38.06 88.37 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.188 -1.005 . . . . 37.25 110.489 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.71 87.7 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.555 -0.858 . . . . 50.079999999999998 110.431 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 14' ' ' LEU . . . . . 0.414 ' HG ' ' HB3' ' H' ' 10' ' ' LEU . 1.0 OUTLIER -52.58 -43.48 65.31 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.265 -0.425 . . . . 47.520000000000003 109.992 173.395 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' G' G ' 15' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -61.91 -43.28 99.17 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.163 -0.471 . . . . 44.840000000000003 111.043 -177.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -69.22 -37.68 78.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.143 -1.023 . . . . 48.93 111.202 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 17' ' ' ALA . . . . . 0.451 ' HA ' HD12 ' G' ' 20' ' ' LEU . . . -61.88 -46.04 91.14 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 119.902 -0.719 . . . . 46.560000000000002 110.683 174.752 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 18' ' ' ILE . . . . . . . . . . . . . 4.2 mt -49.34 -53.48 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.021 -0.536 . . . . 46.630000000000003 109.892 174.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.93 -37.12 85.77 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.181 -0.608 . . . . 43.479999999999997 111.596 -175.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' G' ' 17' ' ' ALA . 5.7 mt -63.62 -48.86 75.58 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 118.846 -1.142 . . . . 58.670000000000002 110.397 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 21' ' ' LEU . . . . . 0.49 ' HA ' ' CD1' ' G' ' 24' ' ' TRP . . . -55.9 -41.63 74.79 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.006 0.431 . . . . 61.259999999999998 111.079 178.914 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' G' G ' 22' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -63.15 -40.99 99.16 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.234 -0.587 . . . . 64.420000000000002 110.742 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -55.53 -34.15 64.43 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.497 -0.881 . . . . 64.519999999999996 111.053 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 24' ' ' TRP . . . . . 0.49 ' CD1' ' HA ' ' G' ' 21' ' ' LEU . 2.0 m95 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 119.481 -0.887 . . . . 58.700000000000003 111.888 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.522 -0.127 0 N-CA-C 111.517 0.192 . . . . 62.299999999999997 111.517 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.21 -24.75 56.67 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.952 -0.567 . . . . 62.090000000000003 112.266 -176.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 3' ' ' LEU . . . . . 0.418 ' O ' HD23 ' H' ' 3' ' ' LEU . 6.6 tt -59.64 -33.29 71.33 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.283 -0.567 . . . . 60.090000000000003 110.991 177.132 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -47.38 -63.3 1.08 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.56 0.695 . . . . 68.950000000000003 110.267 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.9 -33.58 74.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.86 -0.609 . . . . 70.569999999999993 111.531 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 6' ' ' LEU . . . . . 0.543 ' HA ' ' HD3' ' F' ' 16' ' ' LYS . 13.9 tp -57.12 -46.34 82.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.643 -0.823 . . . . 50.369999999999997 110.797 177.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.51 -37.81 71.18 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.255 -0.43 . . . . 64.090000000000003 111.021 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 8' ' ' ARG . . . . . . . . . . . . . . . -52.1 -42.94 63.66 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.234 -0.987 . . . . 82.140000000000001 110.016 170.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 9' ' ' LYS . . . . . . . . . . . . . . . -64.63 -47.12 79.72 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.295 0.569 . . . . 69.760000000000005 110.829 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 10' ' ' LEU . . . . . 0.414 ' HB3' ' HG ' ' G' ' 14' ' ' LEU . 1.5 mt -56.63 -48.01 78.44 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.088 -1.045 . . . . 55.759999999999998 110.113 178.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 tt -56.42 -40.88 75.46 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.8 -0.36 . . . . 59.920000000000002 111.264 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.66 -50.82 40.38 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 119.887 -0.725 . . . . 75.569999999999993 111.06 -175.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.75 -37.24 28.8 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.106 0.479 . . . . 60.700000000000003 109.969 171.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.9 -45.34 71.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.974 -0.557 . . . . 62.049999999999997 110.982 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 15' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -67.58 -39.1 84.85 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 118.194 -1.403 . . . . 68.849999999999994 110.507 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 16' ' ' LYS . . . . . . . . . . . . . . . -54.42 -47.43 72.81 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.689 0.756 . . . . 58.109999999999999 110.427 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.32 59.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.756 -0.656 . . . . 53.450000000000003 110.805 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -72.47 -28.69 28.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 118.239 -1.384 . . . . 63.890000000000001 110.791 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 19' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.64 -53.21 41.06 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.241 0.543 . . . . 77.739999999999995 110.092 165.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 mt -60.61 -34.65 74.54 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.472 -0.891 . . . . 68.349999999999994 110.535 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 21' ' ' LEU . . . . . 0.412 HD23 ' O ' ' H' ' 101' ' ' HOH . 2.9 tt -63.3 -50.34 70.46 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.21 0.528 . . . . 72.890000000000001 110.389 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' H' H ' 22' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -65.75 -36.88 84.81 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.23 -0.588 . . . . 103.98 110.709 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 23' ' ' LYS . . . . . . . . . . . . . . . -64.33 -22.23 66.88 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.736 -0.786 . . . . 89.219999999999999 111.709 175.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 24' ' ' TRP . . . . . . . . . . . . . 5.8 m95 . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 108.794 -0.817 . . . . 79.909999999999997 108.794 175.68 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' I' I ' 1' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 1 C--O 1.148 -4.273 0 N-CA-C 107.583 -1.266 . . . . 66.969999999999999 107.583 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -34.53 14.35 Favored 'General case' 0 C--O 1.19 -2.04 0 N-CA-C 117.08 2.252 . . . . 63.950000000000003 117.08 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 9.6 tp -65.94 -42.75 89.63 Favored 'General case' 0 C--O 1.186 -2.287 0 C-N-CA 125.0 1.32 . . . . 43.649999999999999 107.706 173.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 mt -65.94 -30.73 71.35 Favored 'General case' 0 C--O 1.194 -1.853 0 CA-C-O 118.446 -0.788 . . . . 55.619999999999997 112.528 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 5' ' ' GLU . . . . . . . . . . . . . . . -70.36 -40.97 73.73 Favored 'General case' 0 C--O 1.162 -3.529 0 N-CA-C 105.772 -1.936 . . . . 46.810000000000002 105.772 176.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 6' ' ' LEU . . . . . 0.583 HD21 HD11 ' L' ' 6' ' ' LEU . 9.5 tp -60.44 -44.61 95.64 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 117.862 -1.535 . . . . 46.969999999999999 110.465 173.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.11 -45.64 75.51 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.443 0.64 . . . . 44.799999999999997 110.273 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 8' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' I' ' 12' ' ' GLU . 14.1 ttp85 -61.32 -48.79 79.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.565 -0.743 . . . . 42.950000000000003 110.986 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 9' ' ' LYS . . . . . . . . . . . . . 33.6 mmtt -61.26 -37.21 82.29 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 118.76 -1.176 . . . . 39.359999999999999 110.586 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.23 -52.74 60.98 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.184 0.516 . . . . 42.93 110.749 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 11' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.26 -45.12 80.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 36.439999999999998 110.897 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 12' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' I' ' 8' ' ' ARG . 26.5 mt-10 -58.63 -61.43 2.61 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 118.581 -1.248 . . . . 48.329999999999998 110.173 176.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 13' ' ' ALA . . . . . . . . . . . . . . . -39.79 -48.3 2.21 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.158 0.504 . . . . 35.960000000000001 111.725 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 14' ' ' LEU . . . . . 0.518 ' HA ' HD13 ' J' ' 10' ' ' LEU . 3.2 pp -73.2 -32.37 64.76 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 118.071 -1.452 . . . . 57.759999999999998 111.592 -177.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 15' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -60.09 -38.26 82.39 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.725 -1.59 . . . . 46.149999999999999 110.187 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.83 -37.57 79.58 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.712 -0.395 . . . . 46.409999999999997 110.866 174.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.28 84.28 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.251 -0.979 . . . . 60.280000000000001 110.292 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 18' ' ' ILE . . . . . 0.448 HG13 ' O ' ' I' ' 14' ' ' LEU . 24.2 mt -51.18 -49.53 29.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.728 0.775 . . . . 60.210000000000001 109.696 176.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 19' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -59.63 -48.64 80.88 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.648 -0.706 . . . . 57.869999999999997 111.112 -175.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.28 -41.97 98.94 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.221 -0.991 . . . . 73.069999999999993 110.431 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 21' ' ' LEU . . . . . 0.63 ' HA ' HD21 ' J' ' 3' ' ' LEU . 4.3 tt -59.81 -58.63 7.75 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.289 -0.565 . . . . 95.079999999999998 110.64 -177.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' I' I ' 22' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.26 -37.39 62.08 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.079 -1.049 . . . . 67.980000000000004 110.878 -168.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 23' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -70.7 -44.85 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.279 -0.968 . . . . 63.859999999999999 110.79 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 24' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 120.116 -0.634 . . . . 76.510000000000005 111.73 -176.6 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 120.591 0.234 . . . . 80.180000000000007 110.463 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 2' ' ' LYS . . . . . . . . . . . . . . . -56.85 -6.87 0.38 Allowed 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.423 0.527 . . . . 73.329999999999998 112.423 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 3' ' ' LEU . . . . . 0.63 HD21 ' HA ' ' I' ' 21' ' ' LEU . 11.4 tp -36.44 -44.45 0.43 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.587 1.155 . . . . 63.590000000000003 110.402 161.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.26 -43.09 71.22 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.667 -0.813 . . . . 72.629999999999995 111.583 -175.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.68 -41.96 98.27 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 119.186 -1.006 . . . . 68.180000000000007 110.369 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -53.93 -43.53 69.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.478 . . . . 60.600000000000001 110.613 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.33 -53.11 62.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.083 0.468 . . . . 59.640000000000001 110.818 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 8' ' ' ARG . . . . . . . . . . . . . . . -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 63.359999999999999 110.481 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.86 -35.26 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.536 -0.866 . . . . 59.899999999999999 111.274 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 10' ' ' LEU . . . . . 0.518 HD13 ' HA ' ' I' ' 14' ' ' LEU . 80.7 mt -62.21 -48.15 81.28 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 118.919 -1.112 . . . . 56.140000000000001 109.892 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.01 -43.25 73.48 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.18 0.514 . . . . 59.009999999999998 110.789 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.43 -52.51 57.75 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.397 -0.521 . . . . 72.920000000000002 110.531 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.94 -33.69 57.54 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.756 -0.377 . . . . 59.789999999999999 110.404 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 14' ' ' LEU . . . . . 0.481 HD22 HD21 ' I' ' 14' ' ' LEU . 59.4 tp -65.22 -49.35 70.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.157 0.503 . . . . 60.640000000000001 110.86 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 15' ' ' HIS . . . . . . . . . . . . . 33.5 t-80 -66.39 -31.07 71.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 118.145 -1.422 . . . . 77.689999999999998 110.92 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 16' ' ' LYS . . . . . . . . . . . . . . . -61.5 -46.39 90.21 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.214 0.53 . . . . 65.879999999999995 110.335 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.31 85.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.333 -0.394 . . . . 62.990000000000002 111.333 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 18' ' ' ILE . . . . . . . . . . . . . . . -62.97 -48.02 90.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.73 0.776 . . . . 70.629999999999995 109.976 -177.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -73.07 -26.65 61.35 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.595 -0.842 . . . . 125.02 111.3 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 20' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' L' ' 3' ' ' LEU . 11.8 tp -63.45 -35.24 79.79 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.943 -1.103 . . . . 80.459999999999994 110.272 169.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 21' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' J' ' 26' ' ' NH2 . 1.5 tt -64.38 -37.22 86.75 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.93 -0.708 . . . . 61.329999999999998 110.156 172.704 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.16 -47.16 86.33 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.835 -0.746 . . . . 79.640000000000001 110.567 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -73.59 -41.62 62.65 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.302 -0.559 . . . . 93.950000000000003 111.476 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 24' ' ' TRP . . . . . 0.434 ' NE1' ' O ' ' J' ' 101' ' ' HOH . 5.0 m0 -82.65 -66.59 0.87 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.095 0.474 . . . . 81.049999999999997 110.451 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' J' J ' 25' ' ' GLY . . . . . . . . . . . . . . . -90.95 -90.28 1.35 Allowed Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 108.699 -1.761 . . . . 90.640000000000001 108.699 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' J' J ' 26' ' ' NH2 . . . . . 0.648 ' N ' ' O ' ' J' ' 21' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.13 -0.041 . . . . 83.159999999999997 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 1' ' ' SER . . . . . 0.483 ' O ' ' HB2' ' K' ' 4' ' ' LEU . 5.1 p . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.333 0.587 . . . . 38.539999999999999 110.973 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 2' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' K' ' 2' ' ' LYS . 2.5 ttmt -77.85 -46.66 20.8 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 119.09 -1.044 . . . . 68.269999999999996 110.648 -174.457 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 3' ' ' LEU . . . . . 0.503 HD12 ' HB3' ' K' ' 6' ' ' LEU . 11.6 tp -59.45 -38.47 80.84 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 118.531 -1.268 . . . . 32.369999999999997 110.349 170.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 4' ' ' LEU . . . . . 0.51 ' HB3' ' HE ' ' K' ' 8' ' ' ARG . 4.7 mt -46.52 -61.59 1.75 Allowed 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.685 -0.806 . . . . 24.600000000000001 108.93 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 5' ' ' GLU . . . . . 0.455 ' HA ' ' HD2' ' K' ' 8' ' ' ARG . . . -50.73 -41.04 55.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.775 -0.648 . . . . 18.289999999999999 111.135 179.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 6' ' ' LEU . . . . . 0.503 ' HB3' HD12 ' K' ' 3' ' ' LEU . 3.0 tt -56.65 -44.93 81.81 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 118.69 -1.204 . . . . 50.049999999999997 110.313 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.78 -44.55 85.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.078 0.466 . . . . 49.039999999999999 110.499 -177.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 8' ' ' ARG . . . . . 0.51 ' HE ' ' HB3' ' K' ' 4' ' ' LEU . 49.4 mtt180 -53.07 -59.6 4.34 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.907 -0.588 . . . . 64.299999999999997 110.693 177.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 9' ' ' LYS . . . . . 0.511 ' NZ ' ' OE1' ' I' ' 12' ' ' GLU . 15.7 mmtt -62.38 -30.26 71.07 Favored 'General case' 0 C--O 1.16 -3.652 0 O-C-N 121.379 -0.825 . . . . 28.23 112.727 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 10' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' K' ' 10' ' ' LEU . 2.4 tp -67.55 -53.43 28.46 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 119.748 -0.781 . . . . 67.340000000000003 110.541 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 11' ' ' LEU . . . . . 0.553 ' O ' ' NH2' ' M' ' 8' ' ' ARG . 33.4 mt -59.79 -38.3 81.51 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 120.842 -0.343 . . . . 28.239999999999998 110.677 -179.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.41 -50.61 70.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.683 -0.807 . . . . 55.729999999999997 110.553 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 13' ' ' ALA . . . . . 0.556 ' O ' HD13 ' I' ' 6' ' ' LEU . . . -53.97 -48.96 69.8 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.645 0.736 . . . . 41.57 110.793 176.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.68 -49.48 47.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.511 -0.768 . . . . 65.060000000000002 110.469 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 15' ' ' HIS . . . . . 0.781 ' HB2' ' NH2' ' M' ' 8' ' ' ARG . 8.2 t60 -61.21 -36.42 79.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.784 -0.644 . . . . 83.719999999999999 110.999 -177.358 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.91 -34.04 62.11 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 118.047 -1.461 . . . . 63.630000000000003 111.123 -176.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.49 -48.01 75.26 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.66 -0.816 . . . . 41.979999999999997 110.657 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 18' ' ' ILE . . . . . 0.702 HD12 ' HA ' ' K' ' 15' ' ' HIS . 47.2 mt -54.47 -48.72 69.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.356 0.598 . . . . 37.939999999999998 109.95 178.057 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' K' K ' 19' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.11 -33.21 75.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.383 . . . . 63.950000000000003 111.731 -175.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mt -71.56 -34.72 70.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 118.728 -1.189 . . . . 55.909999999999997 111.268 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 21' ' ' LEU . . . . . . . . . . . . . . . -66.82 -30.37 70.54 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.333 -0.947 . . . . 46.759999999999998 111.378 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 22' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -85.5 -8.5 58.31 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.738 0.644 . . . . 43.420000000000002 112.738 176.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -87.11 -25.45 24.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.724 -0.391 . . . . 62.859999999999999 111.358 162.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 24' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -123.64 36.6 4.6 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 122.937 0.495 . . . . 72.319999999999993 112.026 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 25' ' ' GLY . . . . . . . . . . . . . . . 158.75 -126.16 1.63 Allowed Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.898 -0.881 . . . . 56.93 110.898 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 123.524 0.19 . . . . 52.170000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 122.122 0.963 . . . . 72.549999999999997 110.954 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' H ' ' L' ' 2' ' ' LYS . 0.0 OUTLIER -46.45 -37.35 7.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.031 -1.44 . . . . 67.640000000000001 108.612 166.24 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 3' ' ' LEU . . . . . 0.481 ' HA ' HD22 ' J' ' 20' ' ' LEU . 10.1 tp -57.91 -44.99 87.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.074 0.464 . . . . 92.569999999999993 110.723 173.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 26.1 tp -63.3 -40.42 97.29 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 118.382 -1.327 . . . . 66.900000000000006 110.373 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.2 -42.29 94.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.479 -0.889 . . . . 51.649999999999999 109.981 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 6' ' ' LEU . . . . . 0.583 HD11 HD21 ' I' ' 6' ' ' LEU . 1.8 tm? -51.22 -49.53 60.89 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.75 0.786 . . . . 64.879999999999995 110.752 171.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 7' ' ' LEU . . . . . 0.469 HD23 HD23 ' L' ' 11' ' ' LEU . 8.2 tt -61.86 -45.28 94.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.528 -0.76 . . . . 63.829999999999998 111.163 -179.677 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 8' ' ' ARG . . . . . . . . . . . . . . . -63.94 -39.03 93.22 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.647 -0.421 . . . . 66.980000000000004 110.986 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 9' ' ' LYS . . . . . 0.714 ' NZ ' ' O ' ' L' ' 101' ' ' HOH . 35.6 mmtt -67.38 -37.47 83.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.657 -1.217 . . . . 65.200000000000003 110.234 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 mt -55.98 -36.92 68.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.058 -1.057 . . . . 52.670000000000002 110.842 171.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 11' ' ' LEU . . . . . 0.469 HD23 HD23 ' L' ' 7' ' ' LEU . 3.0 mm? -61.92 -58.51 7.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.177 -0.465 . . . . 56.979999999999997 111.179 179.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -57.49 -33.16 67.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.784 -0.766 . . . . 62.409999999999997 110.511 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.65 68.23 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 121.706 -0.621 . . . . 48.189999999999998 111.057 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 14' ' ' LEU . . . . . 0.514 HD21 HD22 ' M' ' 4' ' ' LEU . 4.4 tp -59.71 -34.17 72.57 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 120.412 -0.515 . . . . 75.760000000000005 111.017 178.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 15' ' ' HIS . . . . . 0.508 ' O ' HG12 ' L' ' 18' ' ' ILE . . . -58.09 -50.76 72.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.82 0.343 . . . . 58.619999999999997 110.197 173.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 16' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 118.473 -1.291 . . . . 60.5 110.665 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.33 -58.22 5.8 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.956 -0.698 . . . . 51.299999999999997 110.515 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 18' ' ' ILE . . . . . 0.508 HG12 ' O ' ' L' ' 15' ' ' HIS . 2.8 pt -59.72 -23.06 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 O-C-N 121.956 -0.465 . . . . 71.579999999999998 110.067 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 19' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' L' ' 22' ' ' GLU . 0.3 OUTLIER -64.9 -48.6 73.62 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.004 0.43 . . . . 144.43000000000001 110.241 171.783 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' L' L ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 tp -56.22 -33.23 65.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.185 -0.606 . . . . 66.780000000000001 111.1 172.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.9 -18.51 33.9 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.559 0.948 . . . . 73.560000000000002 113.559 -171.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 22' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' L' ' 19' ' ' GLU . 3.0 mt-10 -81.03 -46.84 14.43 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.535 0.607 . . . . 112.51000000000001 112.576 -166.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' L' L ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -54.14 -31.05 51.31 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.662 -0.415 . . . . 94.010000000000005 111.549 -174.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 24' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 . . . . . 0 C--N 1.326 -0.45 0 C-N-CA 120.337 -0.545 . . . . 84.620000000000005 110.736 169.409 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' M' M ' 1' ' ' SER . . . . . 0.421 ' N ' ' O ' ' M' ' 203' ' ' HOH . 2.9 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-O 121.302 0.572 . . . . 53.850000000000001 110.102 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 2' ' ' LYS . . . . . . . . . . . . . 9.7 mmtt -123.22 -28.57 3.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.241 -0.89 . . . . 67.260000000000005 112.84 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 3' ' ' LEU . . . . . . . . . . . . . . . -57.14 -41.2 78.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.604 -0.839 . . . . 58.07 110.686 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 4' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' M' ' 7' ' ' LEU . 1.2 mt -67.61 -40.23 84.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.221 -0.592 . . . . 86.060000000000002 110.934 -178.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 5' ' ' GLU . . . . . 0.437 ' HA ' ' HE ' ' M' ' 8' ' ' ARG . . . -54.98 -43.55 73.63 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.542 -0.463 . . . . 53.890000000000001 110.894 171.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -59.33 -43.84 92.68 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.396 -0.522 . . . . 36.43 111.165 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 7' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' M' ' 4' ' ' LEU . 5.8 mt -55.49 -49.36 72.75 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 119.92 -0.712 . . . . 38.289999999999999 110.828 177.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 8' ' ' ARG . . . . . 0.781 ' NH2' ' HB2' ' K' ' 15' ' ' HIS . 0.1 OUTLIER -68.14 -43.14 78.97 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.881 -1.128 . . . . 42.189999999999998 111.465 -173.614 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' M' M ' 9' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -61.13 -37.0 81.26 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 117.47 -1.692 . . . . 43.960000000000001 110.267 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 10' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' N' ' 14' ' ' LEU . 26.7 tp -60.89 -57.85 10.9 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.354 -0.538 . . . . 38.789999999999999 110.264 178.584 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mt -65.82 -26.38 67.65 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 119.438 -0.905 . . . . 36.090000000000003 112.024 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 12' ' ' GLU . . . . . 0.604 ' O ' ' HG2' ' M' ' 16' ' ' LYS . 21.5 mt-10 -70.17 -43.34 71.02 Favored 'General case' 0 C--O 1.178 -2.692 0 CA-C-N 120.065 1.302 . . . . 53.539999999999999 108.924 176.555 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.65 -41.87 77.94 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.855 -0.738 . . . . 42.539999999999999 109.764 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 14' ' ' LEU . . . . . 0.606 ' O ' HG13 ' M' ' 18' ' ' ILE . 4.2 tp -62.0 -47.84 82.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.789 -0.641 . . . . 42.909999999999997 110.429 -178.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 15' ' ' HIS . . . . . 0.541 ' HA ' HD12 ' M' ' 18' ' ' ILE . 2.5 t-80 -62.28 -39.08 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.388 -0.369 . . . . 44.82 110.98 -178.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 16' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' M' ' 12' ' ' GLU . 40.8 mmtm -67.23 -39.02 86.18 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.708 -1.197 . . . . 74.980000000000004 110.328 177.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 17' ' ' ALA . . . . . 0.494 ' HB1' ' HG ' ' N' ' 7' ' ' LEU . . . -57.42 -41.88 81.26 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.946 -0.702 . . . . 41.490000000000002 110.358 174.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 18' ' ' ILE . . . . . 0.606 HG13 ' O ' ' M' ' 14' ' ' LEU . 24.3 mt -55.14 -63.84 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.301 -0.629 . . . . 46.32 109.301 174.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 19' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -48.17 -38.67 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.317 -0.553 . . . . 40.390000000000001 111.447 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 20' ' ' LEU . . . . . 0.581 ' HB3' HD11 ' N' ' 3' ' ' LEU . 6.9 mt -64.64 -50.19 68.06 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.959 -0.696 . . . . 36.450000000000003 110.49 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . . . -62.45 -30.55 71.32 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.994 -0.682 . . . . 67.379999999999995 111.376 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 22' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -73.26 -33.56 65.34 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.818 -0.753 . . . . 52.990000000000002 110.718 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.58 -25.02 38.77 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.076 -1.049 . . . . 69.840000000000003 112.289 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 m95 -106.85 9.08 31.0 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.53 0.937 . . . . 58.219999999999999 113.53 -173.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.04 -96.82 0.23 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.512 -0.851 . . . . 80.709999999999994 112.108 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 26' ' ' NH2 . . . . . 0.645 ' N ' ' O ' ' M' ' 202' ' ' HOH . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 122.927 -0.16 . . . . 76.180000000000007 . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 1' ' ' SER . . . . . . . . . . . . . 4.0 t . . . . . 0 CA--C 1.522 -0.127 0 CA-C-O 121.424 0.63 . . . . 64.739999999999995 110.242 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' N' N ' 2' ' ' LYS . . . . . . . . . . . . . . . -91.19 -10.46 41.62 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.192 -0.913 . . . . 63.240000000000002 112.553 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 3' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' M' ' 20' ' ' LEU . 1.3 tt -49.93 -44.72 50.56 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.342 0.591 . . . . 76.189999999999998 109.874 169.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 4' ' ' LEU . . . . . . . . . . . . . . . -63.54 -45.73 89.21 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.999 -0.681 . . . . 65.170000000000002 110.678 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.3 -41.25 96.66 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 119.745 -0.782 . . . . 58.600000000000001 110.091 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 6' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.94 -42.07 93.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.495 -0.482 . . . . 52.289999999999999 110.602 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 7' ' ' LEU . . . . . 0.494 ' HG ' ' HB1' ' M' ' 17' ' ' ALA . 2.0 mt -57.96 -53.47 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 121.01 0.433 . . . . 57.850000000000001 110.706 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.08 -43.36 61.01 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.087 -0.506 . . . . 67.879999999999995 110.939 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 9' ' ' LYS . . . . . . . . . . . . . . . -71.61 -44.55 64.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.239 -0.584 . . . . 57.600000000000001 111.281 -174.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 10' ' ' LEU . . . . . 0.573 ' HB3' HD13 ' M' ' 14' ' ' LEU . 11.1 mt -55.45 -43.0 75.04 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 119.484 -0.887 . . . . 63.600000000000001 109.94 173.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 11' ' ' LEU . . . . . 0.446 HD12 ' O ' ' N' ' 7' ' ' LEU . 2.7 mt -59.05 -44.63 91.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.105 0.479 . . . . 64.060000000000002 111.209 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 12' ' ' GLU . . . . . . . . . . . . . . . -66.44 -45.57 79.38 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 119.837 -0.745 . . . . 78.819999999999993 110.585 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HE3' ' P' ' 9' ' ' LYS . . . -50.78 -38.69 49.73 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.563 -0.455 . . . . 61.159999999999997 109.941 171.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 14' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' M' ' 10' ' ' LEU . 3.3 tm? -67.23 -41.54 85.5 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 120.512 -0.475 . . . . 62.0 110.508 -179.16 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 15' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.51 -51.21 70.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 119.997 -0.681 . . . . 62.840000000000003 110.351 177.575 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 16' ' ' LYS . . . . . 0.448 ' HA ' ' HG2' ' N' ' 19' ' ' GLU . . . -65.41 -37.7 87.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.308 -0.557 . . . . 65.709999999999994 111.021 -176.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.88 83.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.011 -0.675 . . . . 57.229999999999997 110.174 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mt -55.3 -44.68 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-O 121.431 0.634 . . . . 59.579999999999998 109.878 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HG2' ' N' ' 22' ' ' GLU . 10.3 pt-20 -82.95 -29.81 28.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 117.737 -1.585 . . . . 77.379999999999995 112.0 -172.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.37 -31.75 73.09 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 118.548 -1.261 . . . . 71.849999999999994 109.796 170.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' N' N ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' M' ' 7' ' ' LEU . 13.1 tp -66.38 -41.99 88.59 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.731 0.3 . . . . 68.049999999999997 110.752 172.353 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 22' ' ' GLU . . . . . 0.61 ' HG2' ' HA ' ' N' ' 19' ' ' GLU . 11.4 mm-40 -55.91 -41.18 74.16 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.475 -0.49 . . . . 77.260000000000005 110.398 173.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 23' ' ' LYS . . . . . 0.549 ' NZ ' ' OG ' ' P' ' 1' ' ' SER . 25.5 ttpt -58.99 -63.8 1.17 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.914 0.388 . . . . 82.709999999999994 110.56 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' N' N ' 24' ' ' TRP . . . . . 0.425 ' HE3' ' HG2' ' N' ' 23' ' ' LYS . 1.1 p90 . . . . . 0 C--N 1.331 -0.212 0 CA-C-O 120.848 0.356 . . . . 94.790000000000006 110.685 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.513 -0.457 0 N-CA-C 109.14 -0.689 . . . . 45.810000000000002 109.14 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' O' O ' 2' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -121.84 -56.22 1.86 Allowed 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 112.593 0.59 . . . . 52.700000000000003 112.593 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -69.23 -45.34 70.04 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.273 -1.517 . . . . 40.539999999999999 110.557 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.29 -33.07 71.82 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.562 -0.855 . . . . 46.240000000000002 111.161 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 5' ' ' GLU . . . . . 0.455 ' CD ' HH21 ' O' ' 8' ' ' ARG . 3.6 mm-40 -78.05 -28.69 49.02 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 117.932 -1.507 . . . . 37.170000000000002 111.364 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 6' ' ' LEU . . . . . 0.406 HD23 ' N ' ' O' ' 7' ' ' LEU . 1.8 tt -53.52 -46.2 70.03 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.452 -1.299 . . . . 37.57 109.721 163.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 7' ' ' LEU . . . . . 0.406 ' N ' HD23 ' O' ' 6' ' ' LEU . 65.3 tp -60.38 -47.2 87.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.275 -0.875 . . . . 50.219999999999999 110.517 -176.822 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 8' ' ' ARG . . . . . 0.455 HH21 ' CD ' ' O' ' 5' ' ' GLU . 29.2 ttp85 -46.74 -53.91 10.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.821 -0.627 . . . . 48.469999999999999 111.966 173.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.94 -30.18 65.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 117.674 -1.611 . . . . 40.240000000000002 111.137 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 10' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.75 -49.56 74.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 118.707 -1.197 . . . . 35.119999999999997 110.484 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 11' ' ' LEU . . . . . 0.584 ' HB3' ' HG2' ' Q' ' 8' ' ' ARG . 38.0 mt -58.64 -39.57 80.93 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.25 -0.58 . . . . 42.100000000000001 110.63 -179.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -67.17 -41.81 85.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.382 -0.527 . . . . 38.100000000000001 110.958 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.98 89.38 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.116 -0.634 . . . . 38.93 110.031 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 14' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.25 -38.44 91.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.225 -0.443 . . . . 42.460000000000001 110.942 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -56.06 -46.57 78.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 51.039999999999999 110.429 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -78.34 -31.26 48.53 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.806 -1.157 . . . . 51.670000000000002 112.3 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.14 -51.92 67.7 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.918 -0.713 . . . . 48.299999999999997 110.162 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 18' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' O' ' 18' ' ' ILE . 5.0 mm -46.5 -57.65 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 109.697 -0.482 . . . . 36.07 109.697 172.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 19' ' ' GLU . . . . . . . . . . . . . . . -46.74 -64.28 0.81 Allowed 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.487 0.715 . . . . 44.079999999999998 111.386 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.8 -13.41 61.68 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 115.893 -2.323 . . . . 53.119999999999997 112.413 -174.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' O' O ' 21' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.23 -46.46 83.72 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 119.072 -1.051 . . . . 53.960000000000001 109.764 165.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 22' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -81.38 46.49 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.0 -0.741 . . . . 55.960000000000001 109.0 -173.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 23' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -134.63 -22.52 1.67 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.952 -0.567 . . . . 63.859999999999999 112.462 157.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 24' ' ' TRP . . . . . . . . . . . . . . . -95.89 75.79 3.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.366 1.079 . . . . 66.739999999999995 108.355 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.95 54.1 37.77 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.327 -1.109 . . . . 77.390000000000001 110.327 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' O' O ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.106 . . . . 71.939999999999998 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 1' ' ' SER . . . . . 0.549 ' OG ' ' NZ ' ' N' ' 23' ' ' LYS . 1.4 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.36 0.6 . . . . 63.969999999999999 110.341 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -74.96 -5.52 44.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 79.569999999999993 112.385 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 3' ' ' LEU . . . . . 0.582 ' H ' HD12 ' P' ' 3' ' ' LEU . 5.1 mp -53.7 -40.19 65.82 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 120.746 0.307 . . . . 67.849999999999994 110.578 169.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -52.67 63.8 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.75 -0.38 . . . . 71.049999999999997 111.007 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.51 -39.43 83.84 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.763 -0.775 . . . . 63.030000000000001 110.599 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 6' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.51 -42.67 92.75 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.582 -0.847 . . . . 59.740000000000002 110.511 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 7' ' ' LEU . . . . . 0.709 ' HA ' HD12 ' P' ' 10' ' ' LEU . . . -63.63 -44.1 94.89 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 120.939 0.399 . . . . 58.450000000000003 110.709 179.409 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 8' ' ' ARG . . . . . . . . . . . . . . . -53.24 -45.05 68.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.141 0.496 . . . . 63.729999999999997 110.301 175.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 9' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' N' ' 13' ' ' ALA . 4.9 mtmt -60.53 -49.4 77.71 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.169 0.509 . . . . 92.670000000000002 111.135 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 10' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' P' ' 7' ' ' LEU . 4.5 mt -53.6 -49.87 66.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 119.735 -0.786 . . . . 67.159999999999997 109.835 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 tp -61.56 -37.9 85.53 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 119.797 -0.761 . . . . 64.040000000000006 110.548 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 12' ' ' GLU . . . . . . . . . . . . . . . -57.46 -60.31 3.85 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 119.673 -0.811 . . . . 67.900000000000006 110.076 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.25 -34.51 32.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.152 -0.476 . . . . 72.870000000000005 110.296 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 14' ' ' LEU . . . . . 0.631 HD13 HD11 ' P' ' 18' ' ' ILE . 1.8 tm? -64.37 -48.13 76.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.082 -0.508 . . . . 64.709999999999994 110.764 177.627 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 15' ' ' HIS . . . . . 0.665 ' HA ' HD12 ' P' ' 18' ' ' ILE . . . -57.26 -41.2 79.21 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.531 -0.468 . . . . 61.140000000000001 110.642 178.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 16' ' ' LYS . . . . . . . . . . . . . . . -64.59 -46.6 82.0 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.2 0.524 . . . . 52.590000000000003 110.75 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.25 -55.73 5.56 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.835 -0.746 . . . . 59.719999999999999 110.223 168.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 18' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' P' ' 15' ' ' HIS . 14.8 mt -58.97 -35.9 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.188 0.518 . . . . 82.120000000000005 110.515 -174.117 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 19' ' ' GLU . . . . . . . . . . . . . . . -60.74 -43.78 97.5 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.947 -0.701 . . . . 54.450000000000003 110.08 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.51 -45.9 90.38 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 118.847 -1.141 . . . . 66.909999999999997 109.985 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -50.35 -35.96 30.13 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.219 0.533 . . . . 80.079999999999998 111.213 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.81 -55.51 5.42 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.327 0.584 . . . . 73.980000000000004 110.392 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.42 -23.96 64.69 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.774 -0.771 . . . . 70.260000000000005 111.655 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 24' ' ' TRP . . . . . . . . . . . . . 2.1 m95 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 118.075 0.398 . . . . 74.489999999999995 110.842 -174.377 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 1' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 109.266 -0.642 . . . . 58.840000000000003 109.266 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 2' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -51.42 -28.76 13.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.507 -0.77 . . . . 56.439999999999998 110.777 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 3' ' ' LEU . . . . . 0.579 ' O ' ' HG ' ' Q' ' 6' ' ' LEU . 40.7 tp -61.44 -52.02 66.31 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.293 0.568 . . . . 40.159999999999997 111.403 172.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 4' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' Q' ' 8' ' ' ARG . 3.4 mt -61.32 -40.91 95.95 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.545 -0.862 . . . . 55.68 110.808 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 5' ' ' GLU . . . . . . . . . . . . . . . -53.12 -48.29 67.99 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.125 0.488 . . . . 44.75 111.487 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 6' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' Q' ' 3' ' ' LEU . 1.9 pp -67.95 -35.37 78.29 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 117.695 -1.602 . . . . 47.68 111.108 -178.455 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -53.54 -43.15 68.16 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.88 -1.128 . . . . 35.939999999999998 109.864 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 8' ' ' ARG . . . . . 0.584 ' HG2' ' HB3' ' O' ' 11' ' ' LEU . 8.6 mtm-85 -59.26 -54.4 47.31 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.149 -0.478 . . . . 54.149999999999999 111.113 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 9' ' ' LYS . . . . . 0.771 ' HD3' ' HD3' ' S' ' 9' ' ' LYS . 26.2 mmtt -62.86 -33.88 76.2 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 117.907 -1.517 . . . . 41.75 110.328 -175.238 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 10' ' ' LEU . . . . . 0.426 ' CD1' HD12 ' R' ' 10' ' ' LEU . 15.2 tp -59.18 -43.2 92.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 119.494 -0.882 . . . . 44.259999999999998 110.634 172.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mt -69.94 -40.91 75.19 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.065 -1.054 . . . . 35.710000000000001 110.91 -173.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -62.98 -34.89 78.49 Favored 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 119.574 -0.851 . . . . 63.700000000000003 110.072 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.87 -50.68 65.63 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.012 -0.675 . . . . 46.450000000000003 110.678 175.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 14' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' R' ' 10' ' ' LEU . 2.8 tp -56.38 -40.62 74.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.334 0.588 . . . . 44.840000000000003 110.086 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 15' ' ' HIS . . . . . 0.454 ' O ' ' HB ' ' Q' ' 18' ' ' ILE . 68.6 t60 -69.56 -31.87 70.31 Favored 'General case' 0 N--CA 1.44 -0.925 0 C-N-CA 119.479 -0.888 . . . . 47.960000000000001 110.924 -177.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -75.35 -27.46 59.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 117.662 -1.615 . . . . 48.200000000000003 111.32 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.52 -41.74 88.35 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 119.309 -0.956 . . . . 46.439999999999998 110.477 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 18' ' ' ILE . . . . . 0.454 ' HB ' ' O ' ' Q' ' 15' ' ' HIS . 45.3 mt -47.05 -57.16 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.587 0.708 . . . . 41.07 109.501 170.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -61.26 -30.82 70.7 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.012 -0.54 . . . . 66.579999999999998 112.053 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 20' ' ' LEU . . . . . . . . . . . . . 10.9 mt -70.35 -37.25 74.6 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.457 -0.897 . . . . 51.350000000000001 111.114 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 tp -63.55 -42.36 98.39 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.346 -0.942 . . . . 70.010000000000005 110.627 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -58.67 -37.66 76.5 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.784 -0.766 . . . . 51.530000000000001 111.208 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 23' ' ' LYS . . . . . 0.63 ' HG2' ' CD1' ' Q' ' 24' ' ' TRP . 8.4 ttpt -77.53 -64.81 1.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 118.995 -1.082 . . . . 64.969999999999999 111.242 179.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 24' ' ' TRP . . . . . 0.63 ' CD1' ' HG2' ' Q' ' 23' ' ' LYS . 28.1 m0 -86.31 48.33 1.6 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.386 -0.526 . . . . 80.549999999999997 110.956 -178.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Q' Q ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.69 -81.04 0.63 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.445 -0.407 . . . . 65.150000000000006 112.319 173.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.068 . . . . 62.619999999999997 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' R' R ' 1' ' ' SER . . . . . 0.621 ' HG ' ' HZ3' ' T' ' 24' ' ' TRP . 4.6 t . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.219 0.533 . . . . 68.049999999999997 111.972 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 2' ' ' LYS . . . . . 0.403 ' N ' ' OG ' ' R' ' 1' ' ' SER . 8.5 mmtm -70.89 2.52 4.21 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.73 1.011 . . . . 63.270000000000003 113.73 -169.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.55 -26.96 67.29 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.269 -0.972 . . . . 54.689999999999998 111.098 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.94 -39.9 55.15 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 119.09 -1.044 . . . . 65.75 111.086 -179.067 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.02 -42.48 76.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.406 -0.918 . . . . 65.129999999999995 110.283 167.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 6' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' T' ' 16' ' ' LYS . 2.1 tm? -57.57 -47.52 81.86 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.202 0.525 . . . . 52.090000000000003 111.383 177.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 7' ' ' LEU . . . . . 1.0 ' O ' HD12 ' R' ' 11' ' ' LEU . . . -60.96 -50.56 72.91 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.975 0.416 . . . . 53.68 110.747 -178.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 8' ' ' ARG . . . . . 0.546 ' HA ' ' CD1' ' R' ' 11' ' ' LEU . . . -51.7 -38.12 53.7 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 120.402 -0.519 . . . . 86.980000000000004 111.04 175.639 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 9' ' ' LYS . . . . . . . . . . . . . . . -61.31 -54.42 44.16 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 120.365 -0.534 . . . . 77.430000000000007 110.693 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 10' ' ' LEU . . . . . 0.578 ' HB2' HD13 ' Q' ' 14' ' ' LEU . 2.3 mm? -55.5 -35.08 65.21 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 118.716 -1.194 . . . . 50.240000000000002 110.474 177.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 11' ' ' LEU . . . . . 1.0 HD12 ' O ' ' R' ' 7' ' ' LEU . 1.0 OUTLIER -65.54 -53.62 39.54 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.184 -0.606 . . . . 45.93 110.976 -173.494 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' R' R ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -67.39 -29.36 68.85 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 118.591 -1.244 . . . . 80.609999999999999 110.29 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.43 80.66 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.962 -1.095 . . . . 57.090000000000003 110.714 173.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -69.45 -46.6 66.33 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 120.896 0.379 . . . . 49.770000000000003 110.984 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 15' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.71 -44.64 6.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.35 -0.611 . . . . 69.310000000000002 109.35 168.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 16' ' ' LYS . . . . . . . . . . . . . . . -66.58 -47.97 71.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.902 0.382 . . . . 45.32 111.439 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 17' ' ' ALA . . . . . 0.445 ' O ' HD12 ' R' ' 21' ' ' LEU . . . -56.78 -39.58 74.33 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.42 -0.912 . . . . 62.130000000000003 110.855 175.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 18' ' ' ILE . . . . . 0.589 ' HA ' HD12 ' R' ' 21' ' ' LEU . . . -64.62 -51.2 70.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.202 0.525 . . . . 53.240000000000002 110.217 -179.072 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 19' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -57.1 -29.51 63.58 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.541 -0.3 . . . . 87.010000000000005 110.58 176.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 20' ' ' LEU . . . . . 0.4 HD12 HD21 ' Q' ' 3' ' ' LEU . 1.6 tm? -62.68 -57.37 11.27 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.214 -0.594 . . . . 62.899999999999999 109.954 172.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 21' ' ' LEU . . . . . 0.589 HD12 ' HA ' ' R' ' 18' ' ' ILE . 1.2 mt -47.28 -32.16 4.41 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.129 -0.487 . . . . 80.739999999999995 111.29 177.275 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.73 -64.66 0.95 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.553 -0.459 . . . . 78.260000000000005 111.278 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.0 -58.79 3.95 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.955 0.407 . . . . 91.370000000000005 110.956 -169.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 24' ' ' TRP . . . . . 0.46 ' HH2' ' H3 ' ' T' ' 1' ' ' SER . 11.0 m0 -83.59 54.81 2.97 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.93 -1.507 . . . . 87.579999999999998 106.93 172.685 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' R' R ' 25' ' ' GLY . . . . . . . . . . . . . . . -150.03 140.72 8.22 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.602 -1.799 . . . . 64.689999999999998 108.602 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' R' R ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.053 -0.073 . . . . 57.310000000000002 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' S' S ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.507 -0.68 0 N-CA-C 107.965 -1.124 . . . . 63.530000000000001 107.965 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' S' S ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.55 -45.51 85.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.014 -1.448 . . . . 57.979999999999997 111.089 -176.404 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.88 -38.55 76.42 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 119.896 -0.722 . . . . 46.520000000000003 112.061 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 4' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.27 -36.45 83.72 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 119.283 -0.967 . . . . 42.399999999999999 110.36 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.61 -37.68 87.23 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.76 -0.776 . . . . 38.960000000000001 110.94 173.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 6' ' ' LEU . . . . . . . . . . . . . 3.6 tt -59.51 -55.37 35.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.63 0.729 . . . . 43.840000000000003 110.453 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 7' ' ' LEU . . . . . . . . . . . . . 24.7 tp -55.2 -37.34 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 42.899999999999999 110.156 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 8' ' ' ARG . . . . . 0.494 ' NH2' ' O ' ' S' ' 101' ' ' HOH . 38.9 ttp180 -60.27 -57.48 12.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.135 1.161 . . . . 52.280000000000001 114.135 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 9' ' ' LYS . . . . . 0.771 ' HD3' ' HD3' ' Q' ' 9' ' ' LYS . 11.3 mmtt -69.4 -28.09 65.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.809 -0.757 . . . . 48.630000000000003 111.085 -178.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 10' ' ' LEU . . . . . 0.563 HD21 ' HA ' ' T' ' 14' ' ' LEU . 4.9 tp -65.75 -45.93 80.76 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 119.625 -0.83 . . . . 47.93 110.724 173.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 11' ' ' LEU . . . . . . . . . . . . . 6.1 mt -59.13 -43.92 92.0 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 120.094 -0.642 . . . . 47.140000000000001 110.568 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 12' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.84 -42.98 94.79 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.87 -0.732 . . . . 52.649999999999999 110.233 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.27 93.86 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.028 -0.669 . . . . 53.469999999999999 110.255 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 14' ' ' LEU . . . . . 0.586 HD12 ' HB3' ' T' ' 10' ' ' LEU . 1.3 tt -63.25 -42.3 99.18 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.59 -0.444 . . . . 43.789999999999999 110.964 -179.775 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 15' ' ' HIS . . . . . 0.789 ' HA ' HD12 ' S' ' 18' ' ' ILE . 18.0 t60 -59.95 -40.05 87.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.952 0.406 . . . . 58.939999999999998 110.226 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.69 -33.38 74.8 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.997 -1.081 . . . . 74.689999999999998 111.253 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.96 98.05 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.718 -0.793 . . . . 45.840000000000003 110.703 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 18' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' S' ' 15' ' ' HIS . 24.0 mt -53.88 -51.31 46.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 109.634 -0.506 . . . . 53.640000000000001 109.634 175.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 19' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' S' ' 15' ' ' HIS . 21.3 mt-10 -57.4 -42.83 83.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.973 -1.091 . . . . 64.260000000000005 111.4 -179.145 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 20' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' S' ' 20' ' ' LEU . 7.5 mt -69.66 -46.75 65.4 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.132 -1.027 . . . . 57.350000000000001 110.81 -174.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 21' ' ' LEU . . . . . 0.558 HD13 HD12 ' T' ' 3' ' ' LEU . 4.8 tp -51.63 -48.48 63.29 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.201 0.524 . . . . 66.079999999999998 110.495 174.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' S' S ' 22' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -65.43 -45.27 84.52 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 119.385 -0.926 . . . . 75.769999999999996 110.764 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -76.41 -64.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 118.632 -1.227 . . . . 57.549999999999997 111.769 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 24' ' ' TRP . . . . . . . . . . . . . 13.5 m0 . . . . . 0 C--N 1.323 -0.571 0 C-N-CA 119.478 -0.889 . . . . 66.969999999999999 109.699 -176.792 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' T' T ' 1' ' ' SER . . . . . 0.46 ' H3 ' ' HH2' ' R' ' 24' ' ' TRP . 18.9 t . . . . . 0 C--O 1.236 0.362 0 CA-C-O 121.034 0.445 . . . . 63.240000000000002 111.013 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 2' ' ' LYS . . . . . 0.423 ' N ' ' OG ' ' T' ' 1' ' ' SER . . . -78.32 -4.73 49.5 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.025 0.75 . . . . 61.890000000000001 113.025 -177.002 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 3' ' ' LEU . . . . . 0.558 HD12 HD13 ' S' ' 21' ' ' LEU . 1.6 tm? -57.7 -39.18 76.6 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 119.982 -0.687 . . . . 61.479999999999997 110.597 175.262 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 4' ' ' LEU . . . . . . . . . . . . . 22.2 tp -65.78 -42.9 90.2 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.744 -1.182 . . . . 77.829999999999998 110.701 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.69 -43.62 97.5 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.508 -0.877 . . . . 71.409999999999997 110.486 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 6' ' ' LEU . . . . . 0.483 HD23 HD22 ' T' ' 3' ' ' LEU . 6.7 tp -62.29 -40.16 95.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.126 0.489 . . . . 53.380000000000003 111.146 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -61.41 -51.4 68.93 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.412 -0.358 . . . . 70.129999999999995 110.48 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.61 -36.06 44.25 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.6 -0.44 . . . . 77.0 110.524 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 9' ' ' LYS . . . . . . . . . . . . . . . -65.53 -52.84 49.63 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.061 0.458 . . . . 86.430000000000007 111.041 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 10' ' ' LEU . . . . . 0.586 ' HB3' HD12 ' S' ' 14' ' ' LEU . 2.5 mt -52.7 -40.51 63.05 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.776 -0.77 . . . . 72.890000000000001 109.804 176.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tp -65.88 -49.22 68.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.021 -0.536 . . . . 52.969999999999999 110.535 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.51 -40.2 95.19 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.473 -0.491 . . . . 63.030000000000001 110.79 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -38.5 70.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.566 -0.854 . . . . 61.43 110.328 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 14' ' ' LEU . . . . . 0.737 ' O ' HG12 ' T' ' 18' ' ' ILE . 2.2 tt -67.06 -43.83 81.67 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.739 -0.384 . . . . 71.439999999999998 111.252 179.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 15' ' ' HIS . . . . . 0.4 ' HD1' ' C ' ' T' ' 15' ' ' HIS . 0.5 OUTLIER -53.2 -45.4 68.59 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.505 -0.878 . . . . 78.680000000000007 109.737 174.112 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' T' T ' 16' ' ' LYS . . . . . 0.549 ' HB3' HD23 ' R' ' 6' ' ' LEU . 3.2 mptt -59.02 -45.84 89.7 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.276 0.56 . . . . 80.0 110.474 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.52 81.29 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.154 -0.618 . . . . 69.5 110.999 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 18' ' ' ILE . . . . . 0.737 HG12 ' O ' ' T' ' 14' ' ' LEU . 3.7 mm -69.05 -35.89 71.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 C-N-CA 118.699 -1.2 . . . . 67.060000000000002 110.649 -174.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 19' ' ' GLU . . . . . 0.404 ' HA ' ' CD ' ' T' ' 22' ' ' GLU . . . -57.95 -49.66 76.03 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.653 -0.419 . . . . 57.439999999999998 110.901 174.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 20' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.72 82.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.603 -0.839 . . . . 77.150000000000006 110.707 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 21' ' ' LEU . . . . . . . . . . . . . . . -52.12 -42.17 63.1 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.735 0.302 . . . . 91.019999999999996 110.458 173.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 22' ' ' GLU . . . . . 0.577 ' HG3' ' O ' ' T' ' 18' ' ' ILE . 39.0 mt-10 -57.97 -22.35 48.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.81 0.67 . . . . 94.310000000000002 112.81 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' T' T ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -115.83 14.56 16.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.292 0.849 . . . . 78.359999999999999 113.292 -162.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 24' ' ' TRP . . . . . 0.621 ' HZ3' ' HG ' ' R' ' 1' ' ' SER . 0.3 OUTLIER -155.8 101.54 2.14 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.54 -0.911 . . . . 92.859999999999999 108.54 172.971 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' T' T ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.98 39.51 0.04 OUTLIER Glycine 0 C--N 1.332 0.351 0 O-C-N 123.717 0.636 . . . . 109.18000000000001 114.087 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 O-C-N 122.862 -0.199 . . . . 106.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' U' U ' 1' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' U' ' 5' ' ' GLU . 6.4 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.863 0.839 . . . . 46.399999999999999 109.747 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 2' ' ' LYS . . . . . 0.719 ' NZ ' ' O ' ' U' ' 101' ' ' HOH . 2.3 mppt? -87.68 22.23 2.33 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.298 -0.865 . . . . 47.340000000000003 113.061 -167.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 3' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' U' ' 102' ' ' HOH . 4.8 tp -122.61 -49.43 2.01 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 121.962 -0.461 . . . . 34.159999999999997 111.768 166.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.81 -33.6 73.25 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 119.291 -0.964 . . . . 44.390000000000001 110.382 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 5' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' U' ' 1' ' ' SER . 0.5 OUTLIER -70.6 -33.84 71.49 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 118.79 -1.164 . . . . 46.109999999999999 110.878 175.531 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' U' U ' 6' ' ' LEU . . . . . 0.438 HD13 ' O ' ' W' ' 13' ' ' ALA . 3.9 tp -56.06 -49.49 73.61 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.613 0.721 . . . . 48.780000000000001 110.468 168.496 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 7' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.09 -39.97 72.94 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.353 -0.839 . . . . 42.68 110.415 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 ttp85 -60.78 -55.38 33.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.134 -0.485 . . . . 47.530000000000001 110.942 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 9' ' ' LYS . . . . . 0.473 ' HD3' ' HG2' ' W' ' 9' ' ' LYS . 26.1 mttm -64.43 -31.14 72.23 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.996 -1.482 . . . . 57.630000000000003 111.187 -176.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 10' ' ' LEU . . . . . . . . . . . . . 44.7 tp -63.13 -52.1 63.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.723 -1.191 . . . . 39.700000000000003 111.393 171.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.32 -39.33 66.93 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.931 0.396 . . . . 37.619999999999997 110.889 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 12' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' U' ' 15' ' ' HIS . 14.6 mt-10 -59.08 -61.01 2.96 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.207 -0.597 . . . . 62.32 109.725 175.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.46 -42.53 3.31 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.212 0.529 . . . . 48.469999999999999 110.278 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 14' ' ' LEU . . . . . 0.467 HD23 ' O ' ' S' ' 101' ' ' HOH . 0.6 OUTLIER -63.0 -46.91 85.43 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.663 -0.699 . . . . 51.609999999999999 110.978 177.429 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' U' U ' 15' ' ' HIS . . . . . 0.403 ' N ' ' O ' ' U' ' 12' ' ' GLU . 1.7 t60 -51.38 -45.53 62.48 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.561 0.696 . . . . 75.219999999999999 111.199 176.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.06 -23.97 38.15 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 119.539 -0.864 . . . . 64.409999999999997 112.462 -174.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' U' U ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -45.82 92.55 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.23 -0.588 . . . . 46.649999999999999 110.475 167.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 18' ' ' ILE . . . . . . . . . . . . . 68.1 mt -51.45 -61.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.67 -0.493 . . . . 56.810000000000002 109.67 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 19' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -45.87 -39.05 8.06 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.996 0.427 . . . . 63.170000000000002 112.044 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 mt -71.23 -36.63 71.89 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.79 -0.764 . . . . 52.049999999999997 111.127 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 tp -63.23 -41.09 99.07 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.931 -0.708 . . . . 65.180000000000007 110.796 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -56.39 -62.99 1.34 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.191 -0.459 . . . . 46.25 110.777 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -54.38 -61.1 2.53 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.22 -0.592 . . . . 68.349999999999994 111.047 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 24' ' ' TRP . . . . . . . . . . . . . 43.8 m95 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.41 0.624 . . . . 83.390000000000001 111.108 179.174 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 1' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.38 0.61 . . . . 61.280000000000001 110.092 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 2' ' ' LYS . . . . . 0.446 ' HG2' ' N ' ' V' ' 3' ' ' LEU . 0.1 OUTLIER -50.55 -45.83 57.21 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.496 -1.229 . . . . 82.430000000000007 110.267 173.272 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' V' V ' 3' ' ' LEU . . . . . 0.446 ' N ' ' HG2' ' V' ' 2' ' ' LYS . 3.8 tp -68.3 -34.1 75.54 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.441 -0.345 . . . . 69.939999999999998 111.066 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mt -59.03 -52.23 66.65 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.137 -1.025 . . . . 81.900000000000006 110.476 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.66 -38.6 91.72 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 119.56 -0.856 . . . . 57.030000000000001 111.259 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 6' ' ' LEU . . . . . 0.482 ' HA ' ' HD2' ' X' ' 16' ' ' LYS . 8.4 tp -54.22 -51.23 65.1 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.342 0.591 . . . . 59.170000000000002 110.397 176.33 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 7' ' ' LEU . . . . . 0.752 ' O ' HD12 ' V' ' 11' ' ' LEU . 0.6 OUTLIER -55.82 -41.27 73.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.873 -0.603 . . . . 67.319999999999993 110.666 176.83 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' V' V ' 8' ' ' ARG . . . . . . . . . . . . . . . -57.46 -58.87 6.38 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.679 0.752 . . . . 60.57 110.885 -178.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 9' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' X' ' 16' ' ' LYS . 10.9 mttt -69.73 -21.79 63.44 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.307 -1.357 . . . . 64.680000000000007 111.391 -177.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 10' ' ' LEU . . . . . . . . . . . . . 5.6 mt -59.02 -51.83 68.36 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.185 0.517 . . . . 51.75 110.819 168.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 11' ' ' LEU . . . . . 0.752 HD12 ' O ' ' V' ' 7' ' ' LEU . 0.9 OUTLIER -50.78 -42.65 58.07 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.141 -0.482 . . . . 66.409999999999997 110.778 172.616 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' V' V ' 12' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' V' ' 16' ' ' LYS . . . -57.84 -56.99 14.82 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.974 -0.69 . . . . 69.489999999999995 110.644 -179.11 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 13' ' ' ALA . . . . . 0.605 ' HA ' ' HD2' ' V' ' 16' ' ' LYS . . . -50.02 -40.14 43.76 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.041 0.448 . . . . 57.549999999999997 110.554 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 14' ' ' LEU . . . . . 0.406 ' O ' HG13 ' V' ' 18' ' ' ILE . 2.6 tm? -57.65 -57.76 11.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.295 0.569 . . . . 78.480000000000004 110.801 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 15' ' ' HIS . . . . . . . . . . . . . . . -54.26 -35.42 62.5 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.484 -0.486 . . . . 101.20999999999999 111.353 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 16' ' ' LYS . . . . . 0.605 ' HD2' ' HA ' ' V' ' 13' ' ' ALA . 7.8 mttt -64.6 -48.56 74.46 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.773 -0.771 . . . . 112.47 111.177 179.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.66 -42.69 71.65 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.858 -0.737 . . . . 62.100000000000001 110.689 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 18' ' ' ILE . . . . . 0.406 HG13 ' O ' ' V' ' 14' ' ' LEU . 2.6 mt -62.03 -44.38 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.243 0.544 . . . . 62.189999999999998 110.328 -179.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.2 -47.25 78.72 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.954 0.407 . . . . 76.650000000000006 110.785 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 20' ' ' LEU . . . . . . . . . . . . . 9.6 mt -61.64 -46.06 91.4 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.809 -0.756 . . . . 78.239999999999995 110.715 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' V' V ' 21' ' ' LEU . . . . . 0.612 HD22 HG21 ' T' ' 18' ' ' ILE . 2.9 tt -51.2 -52.66 42.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.315 0.579 . . . . 84.150000000000006 110.973 175.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 22' ' ' GLU . . . . . 0.495 ' HB3' ' HG2' ' T' ' 22' ' ' GLU . 16.1 mt-10 -67.03 -38.55 86.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.104 -0.638 . . . . 82.450000000000003 111.255 -173.3 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 23' ' ' LYS . . . . . 0.44 ' HG3' ' CD1' ' V' ' 24' ' ' TRP . 10.3 tptt -65.06 -38.56 91.2 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.322 -0.551 . . . . 97.140000000000001 110.996 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' V' V ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' HG3' ' V' ' 23' ' ' LYS . 64.4 m95 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.255 -0.578 . . . . 69.620000000000005 110.832 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 121.334 0.588 . . . . 56.479999999999997 110.871 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' W' W ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -68.69 -25.45 64.8 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.901 -0.59 . . . . 50.420000000000002 111.958 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 3' ' ' LEU . . . . . 0.808 HD21 ' HA ' ' X' ' 21' ' ' LEU . 13.8 tp -65.76 -43.08 89.96 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.576 -0.449 . . . . 55.700000000000003 111.578 170.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 4' ' ' LEU . . . . . 0.746 HD23 HD11 ' X' ' 21' ' ' LEU . 2.9 mt -66.1 -38.27 87.83 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.949 -0.469 . . . . 56.119999999999997 111.165 177.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.04 -40.31 95.3 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.423 -0.511 . . . . 45.979999999999997 111.202 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.72 -52.37 65.42 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.389 -0.524 . . . . 41.289999999999999 111.195 174.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.22 -42.3 69.67 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.776 -0.769 . . . . 38.380000000000003 110.227 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -55.68 -62.06 1.94 Allowed 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.39 0.676 . . . . 50.460000000000001 111.464 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 9' ' ' LYS . . . . . 0.473 ' HG2' ' HD3' ' U' ' 9' ' ' LYS . 7.9 mttp -69.17 -24.13 64.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 118.243 -1.383 . . . . 74.010000000000005 112.021 -174.735 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 10' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.76 -48.16 78.08 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.738 -0.785 . . . . 44.770000000000003 110.369 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 11' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.7 -37.21 85.58 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 119.328 -0.949 . . . . 36.789999999999999 111.033 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.29 -43.57 94.34 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.784 -1.167 . . . . 55.649999999999999 110.362 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 13' ' ' ALA . . . . . 0.438 ' O ' HD13 ' U' ' 6' ' ' LEU . . . -54.23 -45.43 72.3 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.28 0.562 . . . . 42.659999999999997 110.356 173.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 14' ' ' LEU . . . . . 0.75 HD12 ' HB2' ' X' ' 10' ' ' LEU . 1.9 tt -65.09 -40.74 95.02 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.075 -0.65 . . . . 60.079999999999998 110.852 -178.159 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 15' ' ' HIS . . . . . . . . . . . . . 70.2 t60 -54.81 -39.1 68.14 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 120.888 0.375 . . . . 36.460000000000001 111.177 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -84.39 -28.45 26.93 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.505 -1.678 . . . . 66.349999999999994 111.472 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 17' ' ' ALA . . . . . 0.694 ' O ' HD23 ' W' ' 21' ' ' LEU . . . -59.45 -40.5 87.04 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 119.611 -0.836 . . . . 48.799999999999997 110.419 168.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 18' ' ' ILE . . . . . 0.577 ' HA ' HD21 ' W' ' 21' ' ' LEU . 6.4 mt -60.59 -63.06 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.145 -0.479 . . . . 63.770000000000003 109.84 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' W' W ' 19' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -42.68 -34.68 0.94 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.903 0.382 . . . . 65.0 111.428 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 20' ' ' LEU . . . . . . . . . . . . . 4.4 mt -66.91 -56.02 12.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.457 -0.897 . . . . 55.640000000000001 110.659 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 21' ' ' LEU . . . . . 0.848 HD22 HD11 ' X' ' 7' ' ' LEU . 0.6 OUTLIER -70.81 -19.53 62.67 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 116.096 -2.242 . . . . 59.25 111.436 -173.778 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' W' W ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.57 -3.17 13.73 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.565 0.58 . . . . 56.960000000000001 112.565 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -130.03 -38.12 1.45 Allowed 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 118.061 -1.456 . . . . 56.380000000000003 112.697 156.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' W' W ' 24' ' ' TRP . . . . . . . . . . . . . 18.1 m95 . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.704 0.631 . . . . 60.32 112.704 -173.654 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 1' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.798 0.333 . . . . 67.439999999999998 111.212 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . . . -125.01 -39.71 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 58.920000000000002 111.155 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 3' ' ' LEU . . . . . 0.654 HD22 ' HB3' ' W' ' 21' ' ' LEU . 1.1 tt -60.64 -47.98 83.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 61.600000000000001 111.213 -179.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 4' ' ' LEU . . . . . 0.72 ' HA ' HD12 ' X' ' 7' ' ' LEU . 4.2 mp -58.5 -47.66 83.37 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 123.197 1.475 . . . . 80.799999999999997 109.528 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . . . -54.87 -44.47 74.07 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.975 -1.466 . . . . 86.079999999999998 110.677 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 6' ' ' LEU . . . . . 0.531 ' CD2' HD11 ' X' ' 10' ' ' LEU . 4.3 tt -52.15 -47.28 65.51 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.704 0.764 . . . . 66.349999999999994 110.594 177.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 7' ' ' LEU . . . . . 0.848 HD11 HD22 ' W' ' 21' ' ' LEU . 3.4 mt -64.84 -48.86 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.682 -0.69 . . . . 74.650000000000006 110.898 -175.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 8' ' ' ARG . . . . . . . . . . . . . . . -59.79 -34.0 72.46 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.173 -1.011 . . . . 56.299999999999997 110.886 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . . . -60.54 -50.04 75.12 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.983 -0.687 . . . . 55.079999999999998 110.268 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 10' ' ' LEU . . . . . 0.75 ' HB2' HD12 ' W' ' 14' ' ' LEU . 24.5 mt -62.15 -31.37 71.84 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 118.698 -1.201 . . . . 62.32 111.099 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.3 -37.34 68.98 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.818 -1.153 . . . . 73.129999999999995 111.067 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 12' ' ' GLU . . . . . 0.488 ' O ' ' HE3' ' X' ' 16' ' ' LYS . 1.6 mt-10 -73.7 -41.14 63.02 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 118.837 -1.145 . . . . 100.26000000000001 110.553 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.21 -37.24 66.87 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.166 -0.614 . . . . 67.359999999999999 110.441 170.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.65 -36.91 79.19 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.39 0.276 . . . . 61.909999999999997 110.963 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 15' ' ' HIS . . . . . 0.54 ' NE2' ' OE2' ' X' ' 19' ' ' GLU . 22.9 t-160 -58.16 -53.15 61.55 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.764 0.792 . . . . 73.519999999999996 110.333 175.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 16' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' X' ' 12' ' ' GLU . 2.6 mttt -59.35 -39.03 81.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.664 -0.698 . . . . 76.310000000000002 110.966 177.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.12 91.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.947 0.403 . . . . 90.379999999999995 111.002 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 18' ' ' ILE . . . . . . . . . . . . . . . -61.54 -42.73 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.198 0.523 . . . . 74.989999999999995 109.783 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 19' ' ' GLU . . . . . 0.54 ' OE2' ' NE2' ' X' ' 15' ' ' HIS . 23.7 mt-10 -63.87 -48.84 75.08 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.512 -0.875 . . . . 83.930000000000007 110.962 -176.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 20' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' X' ' 24' ' ' TRP . . . -68.92 -26.77 65.25 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 120.2 -0.6 . . . . 66.349999999999994 111.857 -178.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 21' ' ' LEU . . . . . 0.808 ' HA ' HD21 ' W' ' 3' ' ' LEU . 2.5 tt -75.21 -42.73 54.87 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.493 -0.883 . . . . 88.480000000000004 110.966 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' X' X ' 22' ' ' GLU . . . . . . . . . . . . . . . -62.04 -41.57 98.26 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.17 -0.612 . . . . 112.84999999999999 110.86 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.59 -61.61 1.95 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.183 -0.607 . . . . 107.34999999999999 111.615 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' X' X ' 24' ' ' TRP . . . . . 0.563 ' HB2' ' O ' ' X' ' 20' ' ' LEU . 5.3 m95 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.571 -0.529 . . . . 123.59 109.571 173.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 1' ' ' SER . . . . . 0.48 ' O ' ' OG ' ' Y' ' 1' ' ' SER . 1.5 t . . . . . 0 CA--C 1.514 -0.441 0 CA-C-O 120.841 0.353 . . . . 60.310000000000002 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -120.93 -49.11 2.22 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 115.75 -0.659 . . . . 73.129999999999995 112.423 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 3' ' ' LEU . . . . . 0.463 HD12 ' HB3' ' Y' ' 6' ' ' LEU . 17.9 tp -58.92 -27.83 65.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 118.919 -1.112 . . . . 58.469999999999999 110.767 169.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' Y' ' 7' ' ' LEU . 3.7 mp -48.54 -45.07 36.97 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.222 -0.591 . . . . 52.689999999999998 110.517 168.198 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 5' ' ' GLU . . . . . . . . . . . . . . . -74.91 -34.87 62.21 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 119.893 -0.723 . . . . 50.170000000000002 111.823 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 6' ' ' LEU . . . . . 0.463 ' HB3' HD12 ' Y' ' 3' ' ' LEU . 2.3 tp -50.99 -56.24 13.45 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.333 -0.947 . . . . 43.899999999999999 108.973 170.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 7' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' Y' ' 4' ' ' LEU . 53.2 tp -43.32 -61.18 1.42 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.931 1.292 . . . . 39.039999999999999 111.038 174.508 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 8' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' Y' ' 11' ' ' LEU . . . -56.37 -66.75 0.38 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.709 -0.678 . . . . 62.689999999999998 111.657 -173.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 9' ' ' LYS . . . . . 0.628 ' NZ ' ' OE2' ' A' ' 12' ' ' GLU . 38.7 mttt -54.36 -28.63 44.28 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.453 -1.299 . . . . 48.43 110.487 -175.624 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 10' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' Y' ' 7' ' ' LEU . 28.7 tp -62.01 -46.17 90.4 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.797 -0.761 . . . . 48.530000000000001 110.55 170.926 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 11' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' Y' ' 8' ' ' ARG . 36.0 mt -60.89 -46.56 90.14 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.134 0.492 . . . . 38.719999999999999 110.428 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 12' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -55.04 -43.82 74.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 116.17 -0.468 . . . . 52.390000000000001 110.291 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.17 99.54 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.183 -0.607 . . . . 60.200000000000003 110.306 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 14' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.05 -48.46 78.49 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.364 0.602 . . . . 58.700000000000003 109.843 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' O ' ' Y' ' 101' ' ' HOH . 2.4 t60 -63.53 -29.43 70.69 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.059 -0.657 . . . . 61.789999999999999 110.673 -177.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 16' ' ' LYS . . . . . 0.562 ' HA ' ' HG2' ' Y' ' 19' ' ' GLU . 5.7 mttt -78.42 -31.6 48.26 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.252 -0.979 . . . . 74.430000000000007 111.843 179.165 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 17' ' ' ALA . . . . . 0.556 ' HB3' HD12 ' Z' ' 7' ' ' LEU . . . -58.58 -45.58 88.74 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 119.491 -0.884 . . . . 60.159999999999997 109.909 167.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 18' ' ' ILE . . . . . 0.628 ' HA ' HD12 ' Y' ' 21' ' ' LEU . 13.5 mt -55.76 -47.12 79.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.762 -0.653 . . . . 49.450000000000003 110.455 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 19' ' ' GLU . . . . . 0.562 ' HG2' ' HA ' ' Y' ' 16' ' ' LYS . 1.7 pt-20 -64.97 -37.45 87.69 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.097 -0.641 . . . . 91.430000000000007 111.097 -175.087 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 20' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' Y' ' 17' ' ' ALA . 3.9 mt -62.58 -43.0 99.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 119.187 -1.005 . . . . 51.439999999999998 109.686 175.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 21' ' ' LEU . . . . . 0.628 HD12 ' HA ' ' Y' ' 18' ' ' ILE . 10.6 mt -55.93 -38.89 70.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.644 -0.422 . . . . 69.409999999999997 111.093 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Y' Y ' 22' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -69.52 -55.23 10.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.358 -0.537 . . . . 60.259999999999998 110.956 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 23' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -55.28 -31.01 61.26 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.389 -0.524 . . . . 70.890000000000001 111.645 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 24' ' ' TRP . . . . . . . . . . . . . 7.5 m95 . . . . . 0 C--N 1.327 -0.383 0 C-N-CA 120.422 -0.511 . . . . 88.579999999999998 111.1 172.62 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 1' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.44 -0.578 . . . . 69.359999999999999 109.44 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 2' ' ' LYS . . . . . . . . . . . . . . . -52.45 -25.55 10.38 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.535 -0.757 . . . . 69.810000000000002 111.316 169.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 3' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' Z' ' 6' ' ' LEU . 1.2 tt -59.64 -51.09 71.31 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.133 0.492 . . . . 76.219999999999999 110.848 170.426 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 tp -63.28 -39.13 93.72 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 119.386 -0.926 . . . . 76.959999999999994 110.682 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.25 -46.67 79.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 119.866 -0.734 . . . . 65.739999999999995 110.281 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' Z' ' 3' ' ' LEU . 5.9 tt -49.47 -56.26 10.38 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.323 0.582 . . . . 68.519999999999996 110.721 175.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 7' ' ' LEU . . . . . 0.556 HD12 ' HB3' ' Y' ' 17' ' ' ALA . 1.1 tt -68.04 -34.51 76.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 66.569999999999993 111.2 -171.958 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.35 -47.93 83.61 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.149 -0.62 . . . . 65.560000000000002 110.588 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 9' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' Z' ' 102' ' ' HOH . 63.3 mmtt -65.02 -37.0 86.18 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.061 -1.055 . . . . 65.799999999999997 110.405 -178.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 10' ' ' LEU . . . . . . . . . . . . . . . -63.01 -35.2 79.41 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.409 -0.517 . . . . 60.439999999999998 110.734 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.37 -41.2 85.48 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.334 -0.546 . . . . 71.129999999999995 111.442 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.99 -46.51 88.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.146 -1.022 . . . . 89.700000000000003 109.989 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.62 -33.71 66.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.09 -0.381 . . . . 61.119999999999997 111.234 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 14' ' ' LEU . . . . . 0.563 HD13 HD13 ' Z' ' 18' ' ' ILE . 2.7 tm? -63.63 -60.93 2.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.202 0.525 . . . . 62.219999999999999 110.183 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 15' ' ' HIS . . . . . . . . . . . . . . . -47.02 -40.31 14.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.972 -0.558 . . . . 83.969999999999999 111.395 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 16' ' ' LYS . . . . . 1.093 ' O ' HD12 ' Z' ' 20' ' ' LEU . . . -54.13 -60.71 2.98 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.089 0.471 . . . . 74.849999999999994 110.326 175.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 17' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' Z' ' 20' ' ' LEU . . . -49.53 -46.6 48.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.953 -0.567 . . . . 48.640000000000001 110.945 -179.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 18' ' ' ILE . . . . . 0.644 HG12 HD22 ' X' ' 21' ' ' LEU . 1.5 mp -61.34 -39.93 84.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 119.745 -0.782 . . . . 60.75 109.899 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 19' ' ' GLU . . . . . . . . . . . . . . . -62.01 -47.49 84.52 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 119.962 -0.695 . . . . 67.030000000000001 110.497 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 20' ' ' LEU . . . . . 1.093 HD12 ' O ' ' Z' ' 16' ' ' LYS . 4.0 mp -55.58 -38.97 70.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.865 -0.734 . . . . 72.739999999999995 110.091 178.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' Z' Z ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.24 -50.75 70.49 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.84 -0.744 . . . . 72.010000000000005 110.366 176.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 22' ' ' GLU . . . . . . . . . . . . . . . -51.36 -38.44 53.26 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.994 0.426 . . . . 80.069999999999993 110.764 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 23' ' ' LYS . . . . . . . . . . . . . . . -70.78 -60.73 2.08 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.64 -0.824 . . . . 77.719999999999999 111.112 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 24' ' ' TRP . . . . . . . . . . . . . . . -70.06 110.84 5.33 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.097 -0.377 . . . . 70.920000000000002 110.781 -162.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.46 0 CA-C-N 116.076 -0.511 . . . . 72.409999999999997 112.258 172.18 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 1' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.222 0.534 . . . . 86.760000000000005 109.885 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 2' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -68.55 -44.3 74.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.516 -0.765 . . . . 75.129999999999995 111.254 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 3' ' ' LEU . . . . . . . . . . . . . . . -62.38 -37.8 87.13 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.31 -0.956 . . . . 49.899999999999999 110.638 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.8 -48.28 79.78 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.993 -0.683 . . . . 47.380000000000003 110.717 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.23 -34.01 75.68 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.531 -0.868 . . . . 52.939999999999998 111.21 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 6' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.92 -40.08 94.23 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 119.479 -0.888 . . . . 51.200000000000003 110.705 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 7' ' ' LEU . . . . . . . . . . . . . 5.1 mt -63.03 -44.87 94.71 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 119.512 -0.875 . . . . 57.350000000000001 110.306 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 8' ' ' ARG . . . . . . . . . . . . . . . -49.06 -46.0 43.82 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.442 0.639 . . . . 48.460000000000001 110.296 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 9' ' ' LYS . . . . . . . . . . . . . . . -69.05 -47.2 65.96 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.515 -0.874 . . . . 62.170000000000002 111.28 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 10' ' ' LEU . . . . . . . . . . . . . 12.5 mt -50.62 -52.46 39.21 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.646 0.736 . . . . 46.43 110.129 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -57.14 -61.56 2.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.964 -0.562 . . . . 41.439999999999998 110.686 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 12' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -46.93 -47.38 21.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.043 0.449 . . . . 81.859999999999999 110.995 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.79 -44.82 66.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.961 0.41 . . . . 39.909999999999997 111.169 170.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 14' ' ' LEU . . . . . . . . . . . . . 9.2 tp -65.63 -60.42 2.94 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.805 -0.758 . . . . 66.280000000000001 110.804 -175.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 15' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -39.1 -39.32 0.56 Allowed 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 125.456 1.502 . . . . 49.789999999999999 110.151 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -70.11 -45.92 65.9 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.954 0.407 . . . . 67.519999999999996 111.094 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 -39.68 61.81 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.576 -0.45 . . . . 59.079999999999998 110.568 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.55 -67.37 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.332 -1.729 . . . . 61.020000000000003 106.332 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -41.05 -50.98 3.39 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.961 0.726 . . . . 74.019999999999996 112.961 -176.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.11 -58.66 7.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.583 -0.847 . . . . 67.560000000000002 110.943 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.81 -42.13 88.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.241 -0.584 . . . . 58.920000000000002 111.149 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 22' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -53.24 -49.85 66.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.549 -0.296 . . . . 73.689999999999998 110.357 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -63.57 -24.06 67.65 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.433 -1.307 . . . . 65.150000000000006 112.116 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' a' a ' 24' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 C--N 1.325 -0.462 0 C-N-CA 120.409 -0.516 . . . . 93.579999999999998 111.255 -178.739 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.83 0.348 . . . . 71.540000000000006 110.5 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 3' ' ' LEU . . . . . . . . . . . . . 7.4 mp -62.24 -50.33 72.16 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.987 -0.685 . . . . 66.069999999999993 110.671 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.67 -27.32 58.26 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.425 -0.91 . . . . 65.120000000000005 112.011 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.79 -45.23 93.63 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.23 -0.988 . . . . 82.390000000000001 109.956 171.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tt -50.92 -48.63 60.63 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.3 0.571 . . . . 80.450000000000003 110.622 171.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 7' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.22 -51.99 67.11 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.178 -0.465 . . . . 69.959999999999994 111.487 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 8' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -49.16 -55.87 11.0 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.562 0.696 . . . . 94.870000000000005 110.547 179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 9' ' ' LYS . . . . . . . . . . . . . . . -62.74 -38.52 90.84 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.639 -0.71 . . . . 130.09 111.382 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.63 -45.65 89.26 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.124 -1.03 . . . . 95.489999999999995 110.518 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.05 -41.21 99.43 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 119.162 -1.015 . . . . 58.640000000000001 110.541 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 12' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -55.26 -63.26 1.22 Allowed 'General case' 0 C--O 1.244 0.771 0 C-N-CA 120.51 -0.476 . . . . 79.5 109.957 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.17 15.82 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.236 -0.438 . . . . 75.25 111.715 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.01 -52.04 47.45 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.117 -0.633 . . . . 62.890000000000001 111.091 -176.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' b' b ' 15' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -60.19 -38.83 84.46 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 118.179 -1.408 . . . . 74.900000000000006 110.707 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 16' ' ' LYS . . . . . . . . . . . . . . . -51.29 -52.19 47.45 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.218 0.532 . . . . 93.230000000000004 110.796 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.25 94.16 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 116.136 -0.484 . . . . 86.530000000000001 111.669 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 mt -63.23 -48.81 85.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 119.019 -1.072 . . . . 71.299999999999997 110.08 -173.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.38 -25.34 65.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 117.672 -1.611 . . . . 99.579999999999998 111.543 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mt -63.48 -47.4 81.94 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.154 -1.019 . . . . 84.239999999999995 110.79 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 tt -72.58 -35.16 67.87 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 115.789 -2.364 . . . . 114.11 110.418 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 22' ' ' GLU . . . . . . . . . . . . . . . -43.09 -44.17 4.77 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.114 -0.698 . . . . 89.319999999999993 109.114 173.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . . . -61.75 -69.01 0.27 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.716 -0.674 . . . . 77.060000000000002 110.378 165.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' b' b ' 24' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.47 0.527 0 O-C-N 121.746 -0.597 . . . . 79.739999999999995 111.835 -171.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 1' ' ' SER . . . . . . . . . . . . . 9.9 t . . . . . 0 C--O 1.218 -0.559 0 N-CA-C 111.464 0.172 . . . . 57.75 111.464 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 2' ' ' LYS . . . . . . . . . . . . . . . -59.83 -43.21 94.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.238 0.459 . . . . 57.700000000000003 112.238 -168.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 tp -61.71 -45.29 94.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 118.958 -1.097 . . . . 54.850000000000001 110.66 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 4' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.18 -37.14 71.7 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.07 -0.652 . . . . 44.299999999999997 110.741 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.13 -48.54 81.16 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.238 0.542 . . . . 54.57 110.15 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 tp -48.32 -58.76 4.13 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.695 0.759 . . . . 48.630000000000003 110.419 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 7' ' ' LEU . . . . . . . . . . . . . 6.9 tp -51.4 -63.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.101 -0.954 . . . . 39.609999999999999 110.213 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -47.56 -45.84 27.4 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.707 -0.679 . . . . 75.280000000000001 111.221 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 9' ' ' LYS . . . . . . . . . . . . . 25.4 mmtt -69.42 -32.45 71.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 117.995 -1.482 . . . . 54.920000000000002 110.224 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 tp -62.64 -42.43 99.59 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.319 -0.952 . . . . 53.350000000000001 111.081 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 11' ' ' LEU . . . . . . . . . . . . . 11.8 mt -68.79 -50.16 52.57 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.865 0.364 . . . . 38.649999999999999 111.102 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 12' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -55.64 -36.5 67.09 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.029 -1.068 . . . . 48.530000000000001 110.178 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.23 -44.43 83.82 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 120.123 -0.631 . . . . 61.25 110.696 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -49.55 -54.5 17.72 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.219 0.533 . . . . 53.539999999999999 109.894 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -72.38 -25.29 61.45 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.441 -0.904 . . . . 72.75 111.653 -172.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -72.56 -38.83 67.84 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.159 -1.016 . . . . 50.869999999999997 110.585 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.32 -41.51 93.65 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.551 -0.46 . . . . 62.789999999999999 110.77 170.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 18' ' ' ILE . . . . . . . . . . . . . 66.5 mt -58.96 -53.3 49.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.406 0.622 . . . . 62.5 110.187 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . . . -57.72 -34.23 69.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.381 -0.372 . . . . 53.009999999999998 111.635 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.32 -45.3 63.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.209 -0.996 . . . . 48.880000000000003 111.225 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 21' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.04 -31.02 72.06 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.232 -0.987 . . . . 68.359999999999999 110.944 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 22' ' ' GLU . . . . . . . . . . . . . . . -52.14 -22.18 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.151 -0.619 . . . . 56.479999999999997 111.804 174.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.152 0.501 . . . . 61.759999999999998 110.898 172.434 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' d' d ' 1' ' ' SER . . . . . . . . . . . . . 37.1 t . . . . . 0 CA--C 1.518 -0.276 0 CA-C-O 122.153 0.978 . . . . 68.189999999999998 109.08 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' d' d ' 2' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -56.02 -64.38 0.88 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-N 113.815 -1.538 . . . . 67.5 110.822 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 tp -63.05 -30.63 71.75 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.497 -0.481 . . . . 71.390000000000001 111.609 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 mp -57.17 -52.0 67.05 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.234 0.54 . . . . 74.599999999999994 110.764 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.02 -37.3 83.91 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.321 -0.4 . . . . 71.129999999999995 111.104 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 6' ' ' LEU . . . . . . . . . . . . . 5.5 tt -54.96 -50.49 68.79 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.98 -0.688 . . . . 86.849999999999994 110.799 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.61 -40.52 88.86 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.62 -0.432 . . . . 91.739999999999995 110.91 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 8' ' ' ARG . . . . . . . . . . . . . . . -56.32 -51.69 67.29 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 119.33 -0.948 . . . . 105.39 110.596 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -63.06 -45.44 92.18 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.736 -0.786 . . . . 83.590000000000003 110.853 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 tt -59.57 -38.32 80.82 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.117 0.484 . . . . 65.379999999999995 110.763 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 11' ' ' LEU . . . . . . . . . . . . . . . -63.39 -48.82 76.29 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 120.664 -0.414 . . . . 76.25 110.477 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -67.61 -31.23 71.11 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 116.998 -1.881 . . . . 102.70999999999999 111.418 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.02 -50.24 74.16 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.813 -0.755 . . . . 65.379999999999995 110.577 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 14' ' ' LEU . . . . . . . . . . . . . . . -55.75 -38.62 70.07 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.731 -0.388 . . . . 85.799999999999997 111.272 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 15' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.45 -53.51 57.56 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.31 -0.556 . . . . 124.70999999999999 110.691 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 16' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -69.77 -26.97 64.55 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.421 -1.311 . . . . 77.049999999999997 111.236 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.8 -51.98 66.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.549 -0.861 . . . . 51.409999999999997 110.929 173.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 18' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.87 -29.1 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.552 -0.459 . . . . 75.25 109.985 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.69 -52.04 67.19 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.61 -0.836 . . . . 86.590000000000003 110.482 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' d' d ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -39.86 89.64 Favored 'General case' 0 C--O 1.192 -1.95 0 C-N-CA 118.302 -1.359 . . . . 58.659999999999997 111.221 177.633 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' d' d ' 21' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.86 -66.1 0.59 Allowed 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 117.374 -1.73 . . . . 76.930000000000007 107.952 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 22' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -41.74 -38.67 1.51 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.741 0.817 . . . . 101.54000000000001 110.656 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 23' ' ' LYS . . . . . . . . . . . . . . . -58.67 -58.64 7.67 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.592 -0.443 . . . . 93.599999999999994 111.057 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 24' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -70.33 -9.16 55.35 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.801 -0.76 . . . . 126.53 112.914 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 25' ' ' GLY . . . . . . . . . . . . . . . 131.19 78.39 0.17 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 118.48 0.582 . . . . 104.03 112.847 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' d' d ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 O-C-N 122.952 -0.146 . . . . 55.450000000000003 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.712 0.291 . . . . 56.810000000000002 111.51 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.74 -34.91 70.02 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.605 -0.838 . . . . 64.060000000000002 110.802 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -43.31 93.32 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.926 -0.31 . . . . 79.269999999999996 111.588 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' e' e ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 mt -73.98 -39.81 63.42 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.894 -0.723 . . . . 58.909999999999997 111.554 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.02 -45.75 89.92 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.602 -0.839 . . . . 56.479999999999997 109.984 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 6' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.75 -42.6 99.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.592 -0.443 . . . . 63.270000000000003 110.928 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -61.05 -55.12 36.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 119.985 -0.686 . . . . 55.759999999999998 109.923 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.67 -46.44 1.84 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 123.993 0.917 . . . . 51.560000000000002 110.871 171.625 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' e' e ' 9' ' ' LYS . . . . . . . . . . . . . . . -70.85 -46.73 62.17 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 119.736 -0.785 . . . . 76.439999999999998 111.423 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 10' ' ' LEU . . . . . . . . . . . . . . . -56.01 -43.5 77.77 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.445 -0.902 . . . . 71.510000000000005 109.657 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mt -61.31 -41.14 96.51 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 120.861 -0.335 . . . . 60.07 111.288 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.01 -48.95 61.75 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.447 -0.901 . . . . 62.770000000000003 110.948 -173.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.62 -28.74 70.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 118.252 -1.379 . . . . 54.020000000000003 110.427 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -53.63 56.22 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.147 -0.621 . . . . 62.189999999999998 110.962 171.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' e' e ' 15' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -37.03 67.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 120.376 -0.53 . . . . 70.590000000000003 110.229 179.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' e' e ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.92 -27.41 39.89 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 113.883 -3.127 . . . . 65.590000000000003 110.942 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.85 69.03 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.559 0.695 . . . . 69.060000000000002 109.498 168.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 18' ' ' ILE . . . . . . . . . . . . . 10.2 mt -58.78 -66.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.772 -0.649 . . . . 63.719999999999999 109.414 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 19' ' ' GLU . . . . . . . . . . . . . . . -55.16 -35.6 64.94 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 120.649 -0.42 . . . . 51.07 110.922 -172.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.38 -33.46 75.25 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.946 -0.702 . . . . 73.780000000000001 110.834 175.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.92 -56.99 8.94 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.902 -1.119 . . . . 78.810000000000002 110.25 175.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.92 -21.34 7.67 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.343 0.497 . . . . 64.170000000000002 112.343 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 23' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -81.72 -65.9 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 119.665 -0.814 . . . . 56.789999999999999 110.494 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' e' e ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.318 0 C-N-CA 123.819 0.848 . . . . 68.030000000000001 112.613 -171.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 mmtt . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.091 -0.707 . . . . 95.260000000000005 109.091 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' f' f ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.8 -32.88 60.79 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.503 -0.771 . . . . 91.5 110.631 169.819 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' f' f ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 tt -58.95 -65.38 0.67 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.168 0.587 . . . . 109.15000000000001 111.255 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 5' ' ' GLU . . . . . . . . . . . . . . . -57.94 -28.66 64.5 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.14 -0.624 . . . . 92.659999999999997 111.287 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -59.6 -54.99 40.14 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.864 -0.734 . . . . 78.609999999999999 110.623 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 7' ' ' LEU . . . . . . . . . . . . . . . -51.42 -41.2 60.62 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.18 -0.608 . . . . 81.159999999999997 110.309 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 8' ' ' ARG . . . . . . . . . . . . . . . -60.1 -54.57 44.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.345 0.593 . . . . 80.890000000000001 110.736 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 9' ' ' LYS . . . . . . . . . . . . . . . -55.99 -37.22 68.8 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.317 -0.553 . . . . 88.049999999999997 110.581 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 10' ' ' LEU . . . . . . . . . . . . . . . -59.36 -44.78 92.66 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.3 -0.96 . . . . 89.599999999999994 110.513 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mt -61.88 -39.66 92.72 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 119.781 -0.767 . . . . 78.239999999999995 110.511 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 12' ' ' GLU . . . . . . . . . . . . . . . -58.93 -55.34 36.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.107 -0.637 . . . . 74.0 110.003 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.73 64.66 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.7 -0.682 . . . . 85.790000000000006 111.052 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tp -67.6 -39.6 84.77 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.845 -0.742 . . . . 75.859999999999999 110.751 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.83 -44.64 86.57 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.006 -1.078 . . . . 77.760000000000005 110.056 174.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -58.67 -38.89 79.15 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.601 -0.44 . . . . 79.879999999999995 111.216 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.99 -48.5 73.76 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.318 -0.553 . . . . 75.129999999999995 111.214 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 pt -64.38 -31.07 52.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 C-N-CA 118.717 -1.193 . . . . 80.579999999999998 109.831 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -44.11 94.0 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.957 0.408 . . . . 87.430000000000007 110.688 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 20' ' ' LEU . . . . . . . . . . . . . 11.0 mt -62.65 -31.8 72.73 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.236 -0.986 . . . . 93.230000000000004 110.901 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.1 -40.55 59.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.388 -0.525 . . . . 113.58 111.78 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.2 16.59 0.43 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.686 0.625 . . . . 85.609999999999999 112.686 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -78.52 -34.65 47.12 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.77 0.656 . . . . 89.810000000000002 112.77 -173.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' f' f ' 24' ' ' TRP . . . . . . . . . . . . . 15.3 m95 . . . . . 0 C--N 1.326 -0.452 0 O-C-N 121.997 -0.44 . . . . 125.95999999999999 111.131 -174.65 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MPD . . . . . 0.543 ' H31' ' HE1' ' E' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 101' ' ' PO4 . . . . . 0.463 ' O3 ' ' NH2' ' E' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' I' I ' 101' ' ' PO4 . . . . . 0.443 ' O4 ' ' NH1' ' I' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 101' ' ' PO4 . . . . . 0.408 ' O3 ' ' OE1' ' M' ' 12' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Q' Q ' 101' ' ' CO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 102' ' ' HOH . . . . . 0.439 ' O ' ' HG3' ' B' ' 19' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 101' ' ' HOH . . . . . 0.635 ' O ' HD23 ' A' ' 14' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' F' F ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 101' ' ' HOH . . . . . 0.459 ' O ' ' O ' ' G' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' G' G ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' G' G ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 101' ' ' HOH . . . . . 0.412 ' O ' HD23 ' H' ' 21' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' H' H ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' H' H ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' J' J ' 101' ' ' HOH . . . . . 0.434 ' O ' ' NE1' ' J' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' K' K ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' K' K ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' K' K ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' K' K ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' K' K ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' K' K ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 101' ' ' HOH . . . . . 0.714 ' O ' ' NZ ' ' L' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' L' L ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' L' L ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' M' M ' 201' ' ' HOH . . . . . 0.68 ' O ' ' NH1' ' M' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 202' ' ' HOH . . . . . 0.645 ' O ' ' N ' ' M' ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 203' ' ' HOH . . . . . 0.421 ' O ' ' N ' ' M' ' 1' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' M' M ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' M' M ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' M' M ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' M' M ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' O' O ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Q' Q ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' R' R ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' R' R ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' R' R ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' S' S ' 101' ' ' HOH . . . . . 0.494 ' O ' ' NH2' ' S' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' S' S ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' S' S ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' S' S ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' T' T ' 101' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' T' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' T' T ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' U' U ' 101' ' ' HOH . . . . . 0.719 ' O ' ' NZ ' ' U' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 102' ' ' HOH . . . . . 0.48 ' O ' ' N ' ' U' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' U' U ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' V' V ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' W' W ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' W' W ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' W' W ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Y' Y ' 101' ' ' HOH . . . . . 0.545 ' O ' ' ND1' ' Y' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Y' Y ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Y' Y ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Y' Y ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Y' Y ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 102' ' ' HOH . . . . . 0.543 ' O ' ' NZ ' ' Z' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' Z' Z ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' Z' Z ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' a' a ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' b' b ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' c' c ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' d' d ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' e' e ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' f' f ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' f' f ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' f' f ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . 0.476 ' C ' HD23 ' A' ' 3' ' ' LEU . 1.0 OUTLIER . . . . . 0 C--O 1.241 0.612 0 CA-C-O 120.871 0.367 . . . . 63.3 110.548 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.585 ' HB3' HD11 ' C' ' 20' ' ' LEU . 0.3 OUTLIER -51.01 -39.65 56.29 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.029 -0.987 . . . . 76.2 111.159 -174.527 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 HD23 ' C ' ' A' ' 1' ' ' SER . 1.7 pt? -42.21 -48.77 4.94 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.396 0.887 . . . . 99.58 113.396 178.693 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.724 ' HA ' HD12 ' A' ' 7' ' ' LEU . 24.0 mt -118.2 -20.41 8.61 Favored 'General case' 0 CA--C 1.507 -0.702 0 N-CA-C 114.329 1.233 . . . . 73.73 114.329 -167.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . . . -48.24 -46.04 35.04 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 118.587 -1.245 . . . . 63.5 108.779 153.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' Y' ' 16' ' ' LYS . 8.3 tp -51.57 -49.36 62.23 Favored 'General case' 0 CA--C 1.509 -0.607 0 CA-C-N 115.449 -0.796 . . . . 57.97 111.309 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.724 HD12 ' HA ' ' A' ' 4' ' ' LEU . 0.2 OUTLIER -75.12 -39.5 60.54 Favored 'General case' 0 C--N 1.314 -0.952 0 C-N-CA 118.312 -1.355 . . . . 79.42 113.63 -177.434 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.531 ' NH2' ' O2 ' ' A' ' 101' ' ' MPD . 4.4 ttt-85 -47.46 -49.93 24.28 Favored 'General case' 0 C--N 1.31 -1.129 0 C-N-CA 117.669 -1.612 . . . . 219.37 109.411 176.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -65.86 -46.21 79.3 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.634 -0.826 . . . . 329.97 111.626 -172.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 26.5 tp -59.68 -48.01 83.35 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.731 -0.787 . . . . 213.71 111.12 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 14' ' ' LEU . 3.8 mt -60.46 -39.64 88.31 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 120.236 -0.585 . . . . 71.54 111.683 -178.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.628 ' OE2' ' NZ ' ' Y' ' 9' ' ' LYS . 16.8 mt-10 -65.73 -41.79 91.8 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 119.189 -1.004 . . . . 63.95 110.259 178.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.565 ' HB2' ' HB2' ' C' ' 9' ' ' LYS . . . -50.3 -45.21 54.48 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 119.095 -1.042 . . . . 61.7 109.33 170.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.635 HD23 ' O ' ' C' ' 101' ' ' HOH . 3.2 tp -64.69 -39.35 93.51 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 119.81 -0.756 . . . . 59.33 111.696 179.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.642 ' NE2' ' OE2' ' A' ' 19' ' ' GLU . 15.1 t-160 -55.81 -49.83 72.15 Favored 'General case' 0 CA--C 1.505 -0.752 0 N-CA-C 109.175 -0.676 . . . . 56.17 109.175 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -71.22 -22.71 61.97 Favored 'General case' 0 N--CA 1.444 -0.767 0 C-N-CA 119.542 -0.863 . . . . 78.45 110.948 -179.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.551 ' HA ' HD12 ' A' ' 20' ' ' LEU . . . -67.81 -41.59 82.89 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.691 -0.404 . . . . 58.01 110.528 174.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 31.1 mt -57.55 -48.31 83.35 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.269 0 CA-C-O 121.396 0.617 . . . . 56.95 110.059 169.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.642 ' OE2' ' NE2' ' A' ' 15' ' ' HIS . 52.8 mt-10 -58.88 -46.56 87.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.152 0.501 . . . . 57.28 110.904 -176.257 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 17' ' ' ALA . . . -70.78 -39.61 73.08 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 116.585 -0.279 . . . . 67.62 110.805 -178.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tt -50.56 -56.23 12.65 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 121.464 0.649 . . . . 79.67 110.281 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 86.3 mt-10 -62.28 -46.75 87.41 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.943 -0.572 . . . . 72.5 110.986 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.4 mmtt -61.91 -63.77 1.15 Allowed 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.243 -0.583 . . . . 70.2 110.901 -178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.439 ' HD1' ' O ' ' A' ' 20' ' ' LEU . 2.9 m95 -85.01 50.25 1.9 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.871 0.843 . . . . 76.11 111.061 175.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -125.5 86.76 0.36 Allowed Glycine 0 N--CA 1.451 -0.314 0 N-CA-C 110.493 -1.043 . . . . 66.49 110.493 167.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 115.967 -0.117 . . . . 61.69 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' SER . . . . . . . . . . . . . 2.9 m . . . . . 0 CA--C 1.524 -0.056 0 CA-C-O 120.885 0.374 . . . . 80.97 111.252 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' LYS . . . . . 0.404 ' C ' HD21 ' Z' ' 20' ' ' LEU . . . 55.33 31.27 16.38 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 115.737 -0.665 . . . . 98.01 111.777 -177.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.82 13.89 1.23 Allowed 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.639 0.607 . . . . 93.74 112.639 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' B' ' 7' ' ' LEU . . . -118.93 -44.48 2.61 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 123.392 0.677 . . . . 83.41 112.434 -179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . . . -50.49 -17.99 0.58 Allowed 'General case' 0 C--O 1.24 0.596 0 N-CA-C 113.024 0.75 . . . . 80.73 113.024 -172.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' B' ' 10' ' ' LEU . . . -51.13 -37.28 45.17 Favored 'General case' 0 C--O 1.238 0.485 0 C-N-CA 120.115 -0.634 . . . . 73.92 110.387 165.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.615 ' HA ' HD11 ' A' ' 14' ' ' LEU . 1.5 tm? -52.22 -48.38 65.16 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 120.019 -0.673 . . . . 62.52 109.853 171.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.3 -40.86 95.73 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 119.752 -0.779 . . . . 67.56 110.884 -177.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LYS . . . . . . . . . . . . . . . -67.32 -48.3 67.99 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.13 -0.628 . . . . 71.03 110.867 -175.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' B' ' 6' ' ' LEU . . . -63.63 -28.82 70.18 Favored 'General case' 0 CA--C 1.516 -0.35 0 C-N-CA 120.076 -0.65 . . . . 82.38 110.935 174.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -67.13 -48.58 67.63 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 120.409 -0.516 . . . . 75.17 110.303 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLU . . . . . . . . . . . . . . . -65.87 -41.46 91.58 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 120.223 -0.591 . . . . 83.44 110.876 178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.04 -44.08 30.78 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.239 -0.584 . . . . 80.0 110.83 169.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.425 ' HA ' HD23 ' B' ' 14' ' ' LEU . 1.8 tt -72.12 -40.35 68.2 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 111.896 0.332 . . . . 80.02 111.896 -177.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.694 ' HA ' HD12 ' B' ' 18' ' ' ILE . 6.6 t-160 -49.55 -50.68 41.19 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.107 0.479 . . . . 72.57 110.152 172.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' LYS . . . . . 0.406 ' HA ' ' HD3' ' B' ' 16' ' ' LYS . 49.5 mmtt -68.67 -39.08 80.77 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-N 116.304 -0.407 . . . . 75.19 111.825 -176.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.99 -43.44 78.92 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.05 -0.66 . . . . 89.3 111.488 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ILE . . . . . 0.761 HG21 HD22 ' D' ' 21' ' ' LEU . 9.7 mm -68.03 -33.72 62.74 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 119.784 -0.766 . . . . 94.3 109.972 176.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLU . . . . . 0.551 ' HG2' ' O ' ' B' ' 15' ' ' HIS . 8.5 mt-10 -53.39 -53.84 45.36 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.905 0.384 . . . . 81.09 110.969 171.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' B' ' 102' ' ' HOH . . . -62.3 -48.6 79.16 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 120.27 -0.572 . . . . 79.38 111.426 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LEU . . . . . 0.504 ' O ' HD23 ' B' ' 21' ' ' LEU . . . -57.43 -55.73 31.07 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 120.976 0.417 . . . . 81.04 111.08 -176.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLU . . . . . . . . . . . . . . . -66.87 -19.67 65.78 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.015 -0.674 . . . . 94.17 112.235 177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . . . -72.2 -50.34 28.37 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 118.511 0.596 . . . . 83.82 110.794 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' TRP . . . . . 0.409 ' HA ' ' CE3' ' B' ' 24' ' ' TRP . 12.0 m95 . . . . . 0 C--N 1.321 -0.662 0 C-N-CA 118.979 -1.088 . . . . 99.17 109.741 174.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' SER . . . . . . . . . . . . . 3.0 m . . . . . 0 CA--C 1.513 -0.451 0 CA-C-O 122.085 0.945 . . . . 63.67 110.434 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' LYS . . . . . . . . . . . . . 33.6 mmtm -71.07 -29.48 65.37 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.246 -1.343 . . . . 57.98 112.204 -161.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' C' ' 6' ' ' LEU . 7.0 tp -69.85 -40.48 75.78 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.911 -1.516 . . . . 59.92 111.15 173.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' LEU . . . . . . . . . . . . . 61.1 mt -63.73 -38.27 90.47 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.668 -0.813 . . . . 47.14 110.799 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' C' ' 9' ' ' LYS . . . -63.72 -44.12 94.53 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 120.025 -0.67 . . . . 52.7 110.774 173.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' LEU . . . . . 0.418 ' HB3' ' O ' ' C' ' 3' ' ' LEU . 1.9 tm? -48.84 -49.32 39.79 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.616 0.722 . . . . 52.09 109.977 172.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' LEU . . . . . 0.434 HD11 HD13 ' D' ' 18' ' ' ILE . 8.5 tp -54.17 -50.4 67.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.242 -0.89 . . . . 58.33 110.643 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ARG . . . . . 0.622 ' NH1' ' O ' ' C' ' 101' ' ' HOH . 8.0 ttp85 -59.59 -46.58 88.52 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 120.505 -0.478 . . . . 51.72 111.605 -176.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' LYS . . . . . 0.565 ' HB2' ' HB2' ' A' ' 13' ' ' ALA . 12.5 mmmt -66.37 -38.65 88.05 Favored 'General case' 0 CA--C 1.516 -0.344 0 C-N-CA 118.417 -1.313 . . . . 41.99 110.28 -178.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' LEU . . . . . 0.542 HD21 ' HA ' ' D' ' 14' ' ' LEU . 3.2 tp -50.56 -48.41 57.47 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.095 0.474 . . . . 55.18 110.804 168.207 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' E' ' 4' ' ' LEU . 4.9 mt -71.74 -48.39 47.24 Favored 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 120.732 -0.387 . . . . 43.34 111.121 -169.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' GLU . . . . . 0.572 ' HG3' ' O ' ' C' ' 8' ' ' ARG . 16.3 mt-10 -61.8 -31.74 71.98 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 119.413 -0.915 . . . . 45.49 110.29 176.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.13 -47.5 85.66 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.774 -0.77 . . . . 49.75 110.274 171.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' LEU . . . . . 0.624 ' HG ' HD22 ' D' ' 10' ' ' LEU . 2.1 tp -53.05 -46.93 68.75 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-O 121.278 0.561 . . . . 53.57 110.926 177.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' HIS . . . . . 0.588 ' HA ' HD12 ' C' ' 18' ' ' ILE . . . -77.12 -36.63 55.36 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.145 -0.48 . . . . 63.96 111.588 -171.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LYS . . . . . . . . . . . . . 40.9 mmtt -73.32 -14.82 61.37 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.603 -0.839 . . . . 57.39 111.558 174.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ALA . . . . . . . . . . . . . . . -79.08 -46.63 17.68 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-O 120.961 0.41 . . . . 55.56 110.914 168.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.588 HD12 ' HA ' ' C' ' 15' ' ' HIS . 42.7 mt -57.58 -39.91 72.16 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 C-N-CA 120.467 -0.493 . . . . 53.24 110.426 175.293 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -45.35 -63.89 0.84 Allowed 'General case' 0 C--O 1.236 0.35 0 CA-C-O 121.172 0.51 . . . . 73.19 111.144 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' LEU . . . . . 1.061 ' O ' ' HB2' ' C' ' 24' ' ' TRP . 1.0 OUTLIER -67.72 -30.51 70.02 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 119.995 -0.682 . . . . 77.52 111.494 -177.428 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LEU . . . . . 0.514 ' HB2' HD22 ' D' ' 3' ' ' LEU . 12.5 tp -58.86 -41.57 87.35 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.195 -1.002 . . . . 59.0 110.548 177.327 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -55.15 -63.09 1.27 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.934 0.397 . . . . 72.34 110.805 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 mmmm -79.82 19.04 0.71 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.634 0.605 . . . . 70.1 112.634 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' TRP . . . . . 1.061 ' HB2' ' O ' ' C' ' 20' ' ' LEU . 80.2 m95 . . . . . 0 C--N 1.329 -0.31 0 N-CA-C 112.827 0.677 . . . . 99.37 112.827 -173.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' SER . . . . . 0.528 ' N ' HD12 ' D' ' 4' ' ' LEU . 0.9 OUTLIER . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 121.295 0.569 . . . . 71.73 111.688 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' LYS . . . . . 0.781 ' HB2' HD21 ' F' ' 20' ' ' LEU . 7.5 mtmt -56.61 -67.86 0.27 Allowed 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 114.788 -1.096 . . . . 86.23 111.339 -166.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' LEU . . . . . 0.514 HD22 ' HB2' ' C' ' 21' ' ' LEU . 5.3 tt -67.38 -25.01 65.75 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.088 -1.045 . . . . 86.64 111.274 178.389 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' LEU . . . . . 0.528 HD12 ' N ' ' D' ' 1' ' ' SER . 2.1 mt -60.83 -59.78 4.84 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 120.274 -0.571 . . . . 66.77 110.404 -174.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' GLU . . . . . . . . . . . . . . . -52.99 -36.68 60.67 Favored 'General case' 0 C--O 1.239 0.545 0 CA-C-O 121.196 0.522 . . . . 68.63 110.811 -178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 8.1 tt -58.23 -56.24 24.62 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-O 121.36 0.6 . . . . 87.07 110.909 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' LEU . . . . . 0.419 ' O ' ' HG ' ' D' ' 11' ' ' LEU . 1.8 mt -57.46 -37.35 72.74 Favored 'General case' 0 CA--C 1.514 -0.414 0 C-N-CA 119.576 -0.85 . . . . 71.39 110.658 178.36 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' ARG . . . . . 0.503 ' HA ' HD12 ' D' ' 11' ' ' LEU . . . -56.16 -61.62 2.26 Favored 'General case' 0 C--O 1.239 0.547 0 C-N-CA 120.345 -0.542 . . . . 62.92 110.65 179.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' D' ' 9' ' ' LYS . 26.2 mmtt -59.89 -32.92 71.19 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.01 -1.076 . . . . 69.27 110.811 -178.056 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' LEU . . . . . 0.624 HD22 ' HG ' ' C' ' 14' ' ' LEU . 3.7 mt -54.72 -40.99 69.81 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.009 -0.677 . . . . 71.1 110.789 171.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . 0.503 HD12 ' HA ' ' D' ' 8' ' ' ARG . 7.9 mt -69.09 -40.49 78.37 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 120.198 -0.601 . . . . 63.56 111.227 -179.731 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' GLU . . . . . 0.448 ' OE2' ' NZ ' ' D' ' 9' ' ' LYS . 2.2 tt0 -57.29 -43.67 83.4 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 119.711 -0.796 . . . . 76.89 109.808 175.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.26 -44.54 79.79 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 116.45 -0.341 . . . . 62.22 111.033 173.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' LEU . . . . . 0.922 ' O ' HD12 ' D' ' 18' ' ' ILE . 59.8 tp -56.78 -64.44 0.87 Allowed 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.581 -0.848 . . . . 65.22 109.892 -177.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -53.12 -30.29 35.83 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 119.177 -1.009 . . . . 97.82 111.296 -177.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.02 -61.13 2.87 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.514 -0.874 . . . . 69.56 110.986 173.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' ALA . . . . . 0.408 ' O ' ' HB2' ' D' ' 20' ' ' LEU . . . -60.43 -30.26 69.51 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 119.188 -1.005 . . . . 62.52 111.123 -178.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' ILE . . . . . 0.922 HD12 ' O ' ' D' ' 14' ' ' LEU . 45.1 mm -57.14 -43.88 82.32 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.497 0 CA-C-O 121.297 0.57 . . . . 65.78 109.572 174.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' GLU . . . . . . . . . . . . . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--O 1.241 0.655 0 CA-C-O 121.13 0.49 . . . . 69.83 110.511 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' LEU . . . . . 0.771 HD11 HD12 ' F' ' 6' ' ' LEU . 15.7 mt -42.84 -57.8 2.64 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.291 0.567 . . . . 56.71 109.686 175.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LEU . . . . . 0.761 HD22 HG21 ' B' ' 18' ' ' ILE . 2.7 tt -57.47 -67.1 0.36 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.057 -0.52 . . . . 86.12 110.692 177.055 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' GLU . . . . . 0.681 ' HG3' HG22 ' B' ' 18' ' ' ILE . 2.2 tm-20 -46.66 -24.92 0.62 Allowed 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.022 -0.535 . . . . 94.59 112.112 -168.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' LYS . . . . . . . . . . . . . . . -50.93 -59.1 4.49 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.128 0.489 . . . . 79.18 111.19 170.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' D' ' 21' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 O-C-N 122.13 -0.356 . . . . 87.78 110.854 179.84 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 1' ' ' SER . . . . . 0.743 ' OG ' ' N ' ' E' ' 2' ' ' LYS . 1.2 t . . . . . 0 CA--C 1.515 -0.38 0 N-CA-C 109.126 -0.694 . . . . 55.35 109.126 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 2' ' ' LYS . . . . . 0.743 ' N ' ' OG ' ' E' ' 1' ' ' SER . 19.7 mttt 65.77 -8.59 0.3 Allowed 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 112.934 0.716 . . . . 46.76 112.934 162.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 3' ' ' LEU . . . . . 0.705 ' H ' HD23 ' E' ' 3' ' ' LEU . 10.2 tp -119.67 -34.48 3.76 Favored 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.585 -0.697 . . . . 50.41 112.808 171.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 4' ' ' LEU . . . . . 0.545 ' HB3' HD21 ' C' ' 11' ' ' LEU . 9.7 mt -53.95 -33.6 57.33 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 118.909 -1.116 . . . . 53.23 109.478 161.876 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 5' ' ' GLU . . . . . . . . . . . . . . . -58.07 -55.34 36.17 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.994 0.426 . . . . 47.72 111.033 172.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 6' ' ' LEU . . . . . 0.643 ' HB3' HD12 ' E' ' 3' ' ' LEU . 6.1 tt -61.32 -52.12 65.99 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.009 -0.676 . . . . 55.74 110.792 -177.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 7' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' E' ' 11' ' ' LEU . 4.2 tp -44.35 -52.15 7.9 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-O 121.328 0.585 . . . . 59.07 110.369 174.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 8' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' E' ' 4' ' ' LEU . 2.0 ttp85 -58.98 -45.45 90.55 Favored 'General case' 0 C--O 1.191 -1.998 0 N-CA-C 115.764 1.765 . . . . 59.75 115.764 -176.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 9' ' ' LYS . . . . . 0.614 ' HG2' ' HD2' ' G' ' 9' ' ' LYS . 10.3 mttm -79.44 -31.24 42.49 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.616 -0.677 . . . . 47.34 112.003 -179.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 10' ' ' LEU . . . . . . . . . . . . . 21.0 tp -56.18 -46.95 79.17 Favored 'General case' 0 CA--C 1.515 -0.378 0 C-N-CA 119.76 -0.776 . . . . 39.87 110.14 169.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 11' ' ' LEU . . . . . 0.667 ' HA ' HD12 ' E' ' 14' ' ' LEU . 95.9 mt -63.08 -41.34 99.4 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 119.845 -0.742 . . . . 57.04 111.28 -178.302 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -60.99 -37.99 84.46 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 119.039 -1.064 . . . . 66.34 110.084 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 13' ' ' ALA . . . . . 0.581 ' HB3' ' O ' ' E' ' 102' ' ' HOH . . . -57.12 -47.31 81.42 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.109 0.48 . . . . 34.65 110.648 172.738 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 14' ' ' LEU . . . . . 0.667 HD12 ' HA ' ' E' ' 11' ' ' LEU . 1.3 mt -54.16 -46.07 72.2 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 120.985 0.421 . . . . 58.28 111.522 175.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 15' ' ' HIS . . . . . 0.744 ' HA ' HD12 ' E' ' 18' ' ' ILE . 15.5 t-160 -65.49 -43.5 90.02 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-O 120.761 0.315 . . . . 45.41 111.073 -174.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 16' ' ' LYS . . . . . 0.623 ' O ' ' HG ' ' E' ' 20' ' ' LEU . 27.6 mmtt -70.42 -33.56 71.48 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.579 -1.248 . . . . 54.67 111.167 179.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.15 -47.07 82.08 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.133 -0.627 . . . . 62.44 110.267 171.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 18' ' ' ILE . . . . . 0.744 HD12 ' HA ' ' E' ' 15' ' ' HIS . 27.8 mt -52.32 -54.48 14.52 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 CA-C-O 121.492 0.663 . . . . 56.42 109.853 176.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 19' ' ' GLU . . . . . 0.6 ' HG3' ' O ' ' E' ' 15' ' ' HIS . 53.8 mt-10 -59.35 -51.7 68.8 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 120.264 -0.574 . . . . 52.0 111.344 -173.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 20' ' ' LEU . . . . . 0.874 HD13 HD11 ' F' ' 3' ' ' LEU . 1.2 pp -69.54 -28.48 66.05 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.258 -1.377 . . . . 80.19 111.519 -175.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 21' ' ' LEU . . . . . 0.623 ' HB2' ' CD2' ' F' ' 3' ' ' LEU . 3.9 tp -57.25 -52.15 66.49 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 119.986 -0.685 . . . . 100.87 110.211 170.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' E' E ' 22' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.75 -32.48 63.85 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.29 -0.964 . . . . 105.44 112.149 -172.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 23' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -66.84 -61.72 1.81 Allowed 'General case' 0 C--O 1.233 0.234 0 C-N-CA 120.634 -0.426 . . . . 81.3 111.237 -165.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 24' ' ' TRP . . . . . . . . . . . . . 13.6 p-90 -90.61 84.2 5.89 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 106.664 -1.606 . . . . 72.01 106.664 172.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 25' ' ' GLY . . . . . . . . . . . . . . . 140.21 -126.8 3.31 Favored Glycine 0 N--CA 1.45 -0.384 0 N-CA-C 110.006 -1.238 . . . . 80.87 110.006 -171.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 116.822 0.311 . . . . 77.58 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 1' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.224 -0.237 0 CA-C-O 121.16 0.505 . . . . 70.0 110.45 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 2' ' ' LYS . . . . . . . . . . . . . . . -71.64 9.98 0.75 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 122.972 1.368 . . . . 68.57 112.641 177.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 3' ' ' LEU . . . . . 0.874 HD11 HD13 ' E' ' 20' ' ' LEU . 2.7 tt -61.44 -42.83 99.37 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.855 -1.066 . . . . 60.36 111.122 174.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.65 -41.15 89.92 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.956 -0.698 . . . . 84.19 110.241 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.49 -35.72 81.4 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.063 -0.655 . . . . 107.65 110.864 175.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 6' ' ' LEU . . . . . 0.771 HD12 HD11 ' D' ' 20' ' ' LEU . 7.9 tp -56.77 -43.2 80.59 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.375 0.607 . . . . 79.11 110.484 173.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 7' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' F' ' 11' ' ' LEU . 2.4 mt -63.69 -42.74 97.95 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 119.921 -0.712 . . . . 51.23 110.89 177.606 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 8' ' ' ARG . . . . . 0.659 ' HA ' HD12 ' F' ' 11' ' ' LEU . 40.7 ttt85 -59.27 -39.08 81.77 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.94 0.4 . . . . 78.0 111.157 178.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.74 -48.66 68.46 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 120.463 -0.495 . . . . 53.17 110.873 -179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 10' ' ' LEU . . . . . 0.528 ' HB3' ' HG ' ' E' ' 14' ' ' LEU . 7.9 mt -58.36 -34.52 70.76 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 118.461 -1.296 . . . . 59.11 110.687 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 11' ' ' LEU . . . . . 0.659 HD12 ' HA ' ' F' ' 8' ' ' ARG . 2.4 mt -62.15 -62.28 1.88 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 120.552 -0.459 . . . . 56.08 110.866 176.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -50.12 -38.46 39.03 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-O 120.895 0.378 . . . . 87.71 110.788 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.42 -47.47 85.33 Favored 'General case' 0 C--O 1.239 0.535 0 C-N-CA 120.45 -0.5 . . . . 54.07 111.145 176.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 14' ' ' LEU . . . . . 0.486 HD11 HD23 ' E' ' 11' ' ' LEU . 29.0 tp -64.39 -36.47 84.24 Favored 'General case' 0 C--O 1.234 0.288 0 C-N-CA 118.91 -1.116 . . . . 56.47 111.081 178.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 15' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -54.56 -52.68 61.31 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 119.864 -0.735 . . . . 65.91 110.247 176.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 16' ' ' LYS . . . . . 0.543 ' HD3' ' HA ' ' H' ' 6' ' ' LEU . 8.6 mttt -61.27 -40.83 95.56 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 116.059 -0.519 . . . . 78.37 110.918 -178.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.1 79.36 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 120.07 -0.652 . . . . 54.92 110.985 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 18' ' ' ILE . . . . . 0.68 ' HA ' HD12 ' F' ' 21' ' ' LEU . . . -68.26 -49.84 63.2 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 CA-C-O 121.653 0.739 . . . . 59.53 110.441 178.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.59 -34.46 67.2 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 120.161 -0.616 . . . . 70.15 110.911 177.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 20' ' ' LEU . . . . . 0.781 HD21 ' HB2' ' D' ' 2' ' ' LYS . . . -76.27 -36.6 58.34 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.261 -0.576 . . . . 62.74 111.826 179.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 21' ' ' LEU . . . . . 0.68 HD12 ' HA ' ' F' ' 18' ' ' ILE . 2.6 mt -51.62 -46.37 63.6 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 121.271 0.558 . . . . 70.72 109.902 170.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.51 -49.78 76.47 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.359 -0.536 . . . . 79.81 110.932 171.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 23' ' ' LYS . . . . . 0.543 ' HE2' ' HD3' ' D' ' 2' ' ' LYS . 54.6 tptt -57.38 -40.17 77.6 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 116.467 -0.333 . . . . 86.62 111.753 -168.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 24' ' ' TRP . . . . . 0.41 ' CE3' ' HA ' ' F' ' 24' ' ' TRP . 1.6 m95 -109.17 -53.6 2.63 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 113.246 0.832 . . . . 92.61 113.246 -176.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' F' F ' 25' ' ' GLY . . . . . . . . . . . . . . . -73.73 -91.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.866 -0.683 . . . . 90.25 113.105 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' F' F ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.098 -0.051 . . . . 84.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 1' ' ' SER . . . . . 0.46 ' O ' ' HG2' ' G' ' 5' ' ' GLU . 28.7 t . . . . . 0 C--O 1.237 0.406 0 CA-C-O 121.508 0.67 . . . . 59.69 109.55 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 2' ' ' LYS . . . . . . . . . . . . . 1.7 mttp -60.65 -26.09 66.8 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-N 115.028 -0.987 . . . . 66.06 111.364 -177.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 3' ' ' LEU . . . . . 0.656 HD12 ' H ' ' G' ' 3' ' ' LEU . 1.2 mp -59.85 -58.59 7.91 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.223 0.535 . . . . 65.1 110.822 174.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mt -62.96 -34.79 78.26 Favored 'General case' 0 CA--C 1.509 -0.608 0 C-N-CA 120.838 -0.345 . . . . 43.04 111.51 -178.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 5' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' G' ' 1' ' ' SER . 1.8 mm-40 -73.26 -30.43 63.45 Favored 'General case' 0 C--O 1.238 0.478 0 C-N-CA 117.874 -1.531 . . . . 44.23 110.978 -179.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 6' ' ' LEU . . . . . . . . . . . . . 12.4 tp -56.07 -46.87 78.83 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 121.453 0.644 . . . . 49.07 110.042 165.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 7' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' G' ' 7' ' ' LEU . 0.0 OUTLIER -56.19 -39.8 72.97 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.864 -0.607 . . . . 45.67 110.796 176.565 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' G' G ' 8' ' ' ARG . . . . . . . . . . . . . 13.5 ttt180 -60.63 -51.66 68.45 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 116.051 -0.522 . . . . 64.53 110.979 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 9' ' ' LYS . . . . . 0.614 ' HD2' ' HG2' ' E' ' 9' ' ' LYS . 32.5 mmtt -59.58 -38.67 81.81 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 119.319 -0.952 . . . . 34.75 110.036 178.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 10' ' ' LEU . . . . . . . . . . . . . 2.0 tp -55.86 -52.72 63.07 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 119.946 -0.702 . . . . 47.7 110.985 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 11' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' G' ' 11' ' ' LEU . 20.5 mt -65.34 -42.79 92.53 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 111.688 0.255 . . . . 36.25 111.688 -173.908 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 12' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -62.47 -38.06 88.37 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.188 -1.005 . . . . 37.25 110.489 178.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 13' ' ' ALA . . . . . . . . . . . . . . . -65.15 -44.71 87.7 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 119.555 -0.858 . . . . 50.08 110.431 177.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 14' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' G' ' 14' ' ' LEU . 1.0 OUTLIER -52.58 -43.48 65.31 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 116.265 -0.425 . . . . 47.52 109.992 173.395 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' G' G ' 15' ' ' HIS . . . . . . . . . . . . . 8.9 t-160 -61.91 -43.28 99.17 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 116.163 -0.471 . . . . 44.84 111.043 -177.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 16' ' ' LYS . . . . . . . . . . . . . 43.3 mmtt -69.22 -37.68 78.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 119.143 -1.023 . . . . 48.93 111.202 -178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 17' ' ' ALA . . . . . 0.451 ' HA ' HD12 ' G' ' 20' ' ' LEU . . . -61.88 -46.04 91.14 Favored 'General case' 0 C--O 1.24 0.563 0 C-N-CA 119.902 -0.719 . . . . 46.56 110.683 174.752 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 18' ' ' ILE . . . . . . . . . . . . . 4.2 mt -49.34 -53.48 8.66 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 CA-C-N 116.021 -0.536 . . . . 46.63 109.892 174.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 19' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -62.93 -37.12 85.77 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 120.181 -0.608 . . . . 43.48 111.596 -175.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 20' ' ' LEU . . . . . 0.451 HD12 ' HA ' ' G' ' 17' ' ' ALA . 5.7 mt -63.62 -48.86 75.58 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 118.846 -1.142 . . . . 58.67 110.397 177.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 21' ' ' LEU . . . . . 0.49 ' HA ' ' CD1' ' G' ' 24' ' ' TRP . . . -55.9 -41.63 74.79 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 121.006 0.431 . . . . 61.26 111.079 178.914 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' G' G ' 22' ' ' GLU . . . . . . . . . . . . . 64.6 mt-10 -63.15 -40.99 99.16 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.234 -0.587 . . . . 64.42 110.742 178.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -55.53 -34.15 64.43 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 119.497 -0.881 . . . . 64.52 111.053 172.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 24' ' ' TRP . . . . . 0.49 ' CD1' ' HA ' ' G' ' 21' ' ' LEU . 2.0 m95 . . . . . 0 N--CA 1.471 0.623 0 C-N-CA 119.481 -0.887 . . . . 58.7 111.888 170.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 1' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 CA--C 1.522 -0.127 0 N-CA-C 111.517 0.192 . . . . 62.3 111.517 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.21 -24.75 56.67 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.952 -0.567 . . . . 62.09 112.266 -176.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 3' ' ' LEU . . . . . 0.418 ' O ' HD23 ' H' ' 3' ' ' LEU . 6.6 tt -59.64 -33.29 71.33 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.283 -0.567 . . . . 60.09 110.991 177.132 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 4' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -47.38 -63.3 1.08 Allowed 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.56 0.695 . . . . 68.95 110.267 175.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.9 -33.58 74.99 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 115.86 -0.609 . . . . 70.57 111.531 -177.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 6' ' ' LEU . . . . . 0.543 ' HA ' ' HD3' ' F' ' 16' ' ' LYS . 13.9 tp -57.12 -46.34 82.72 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.643 -0.823 . . . . 50.37 110.797 177.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 tt -71.51 -37.81 71.18 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 116.255 -0.43 . . . . 64.09 111.021 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 8' ' ' ARG . . . . . . . . . . . . . . . -52.1 -42.94 63.66 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 119.234 -0.987 . . . . 82.14 110.016 170.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 9' ' ' LYS . . . . . . . . . . . . . . . -64.63 -47.12 79.72 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.295 0.569 . . . . 69.76 110.829 -178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 10' ' ' LEU . . . . . 0.414 ' HB3' ' HG ' ' G' ' 14' ' ' LEU . 1.5 mt -56.63 -48.01 78.44 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.088 -1.045 . . . . 55.76 110.113 178.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 tt -56.42 -40.88 75.46 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.8 -0.36 . . . . 59.92 111.264 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.66 -50.82 40.38 Favored 'General case' 0 C--O 1.241 0.618 0 C-N-CA 119.887 -0.725 . . . . 75.57 111.06 -175.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 13' ' ' ALA . . . . . . . . . . . . . . . -49.75 -37.24 28.8 Favored 'General case' 0 CA--C 1.511 -0.549 0 CA-C-O 121.106 0.479 . . . . 60.7 109.969 171.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 14' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -68.9 -45.34 71.16 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 115.974 -0.557 . . . . 62.05 110.982 -174.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 15' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -67.58 -39.1 84.85 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 118.194 -1.403 . . . . 68.85 110.507 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 16' ' ' LYS . . . . . . . . . . . . . . . -54.42 -47.43 72.81 Favored 'General case' 0 C--O 1.24 0.569 0 CA-C-O 121.689 0.756 . . . . 58.11 110.427 174.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 17' ' ' ALA . . . . . . . . . . . . . . . -56.96 -53.32 59.37 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.756 -0.656 . . . . 53.45 110.805 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 18' ' ' ILE . . . . . . . . . . . . . 30.9 mt -72.47 -28.69 28.91 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 C-N-CA 118.239 -1.384 . . . . 63.89 110.791 -171.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 19' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -51.64 -53.21 41.06 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-O 121.241 0.543 . . . . 77.74 110.092 165.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 20' ' ' LEU . . . . . . . . . . . . . 40.1 mt -60.61 -34.65 74.54 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 119.472 -0.891 . . . . 68.35 110.535 178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 21' ' ' LEU . . . . . 0.412 HD23 ' O ' ' H' ' 101' ' ' HOH . 2.9 tt -63.3 -50.34 70.46 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.21 0.528 . . . . 72.89 110.389 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' H' H ' 22' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -65.75 -36.88 84.81 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.23 -0.588 . . . . 103.98 110.709 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 23' ' ' LYS . . . . . . . . . . . . . . . -64.33 -22.23 66.88 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 119.736 -0.786 . . . . 89.22 111.709 175.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 24' ' ' TRP . . . . . . . . . . . . . 5.8 m95 . . . . . 0 C--N 1.328 -0.342 0 N-CA-C 108.794 -0.817 . . . . 79.91 108.794 175.68 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' I' I ' 1' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 1 C--O 1.148 -4.273 0 N-CA-C 107.583 -1.266 . . . . 66.97 107.583 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 2' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.13 -34.53 14.35 Favored 'General case' 0 C--O 1.19 -2.04 0 N-CA-C 117.08 2.252 . . . . 63.95 117.08 178.489 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 3' ' ' LEU . . . . . . . . . . . . . 9.6 tp -65.94 -42.75 89.63 Favored 'General case' 0 C--O 1.186 -2.287 0 C-N-CA 125.0 1.32 . . . . 43.65 107.706 173.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 4' ' ' LEU . . . . . . . . . . . . . 4.9 mt -65.94 -30.73 71.35 Favored 'General case' 0 C--O 1.194 -1.853 0 CA-C-O 118.446 -0.788 . . . . 55.62 112.528 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 5' ' ' GLU . . . . . . . . . . . . . . . -70.36 -40.97 73.73 Favored 'General case' 0 C--O 1.162 -3.529 0 N-CA-C 105.772 -1.936 . . . . 46.81 105.772 176.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 6' ' ' LEU . . . . . 0.583 HD21 HD11 ' L' ' 6' ' ' LEU . 9.5 tp -60.44 -44.61 95.64 Favored 'General case' 0 C--N 1.3 -1.551 0 C-N-CA 117.862 -1.535 . . . . 46.97 110.465 173.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -55.11 -45.64 75.51 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 121.443 0.64 . . . . 44.8 110.273 -179.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 8' ' ' ARG . . . . . 0.53 ' O ' ' HG3' ' I' ' 12' ' ' GLU . 14.1 ttp85 -61.32 -48.79 79.71 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.565 -0.743 . . . . 42.95 110.986 -179.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 9' ' ' LYS . . . . . . . . . . . . . 33.6 mmtt -61.26 -37.21 82.29 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 118.76 -1.176 . . . . 39.36 110.586 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 10' ' ' LEU . . . . . . . . . . . . . 2.1 tp -63.23 -52.74 60.98 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-O 121.184 0.516 . . . . 42.93 110.749 179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 11' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.26 -45.12 80.22 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.017 -0.538 . . . . 36.44 110.897 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 12' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' I' ' 8' ' ' ARG . 26.5 mt-10 -58.63 -61.43 2.61 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 118.581 -1.248 . . . . 48.33 110.173 176.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 13' ' ' ALA . . . . . . . . . . . . . . . -39.79 -48.3 2.21 Favored 'General case' 0 C--O 1.236 0.355 0 CA-C-O 121.158 0.504 . . . . 35.96 111.725 179.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 14' ' ' LEU . . . . . 0.518 ' HA ' HD13 ' J' ' 10' ' ' LEU . 3.2 pp -73.2 -32.37 64.76 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 118.071 -1.452 . . . . 57.76 111.592 -177.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 15' ' ' HIS . . . . . . . . . . . . . 9.3 t-80 -60.09 -38.26 82.39 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 117.725 -1.59 . . . . 46.15 110.187 173.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 16' ' ' LYS . . . . . . . . . . . . . . . -59.83 -37.57 79.58 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 120.712 -0.395 . . . . 46.41 110.866 174.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.34 -47.28 84.28 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.251 -0.979 . . . . 60.28 110.292 174.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 18' ' ' ILE . . . . . 0.448 HG13 ' O ' ' I' ' 14' ' ' LEU . 24.2 mt -51.18 -49.53 29.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-O 121.728 0.775 . . . . 60.21 109.696 176.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 19' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -59.63 -48.64 80.88 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-N 115.648 -0.706 . . . . 57.87 111.112 -175.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 20' ' ' LEU . . . . . . . . . . . . . 16.6 mt -62.28 -41.97 98.94 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.221 -0.991 . . . . 73.07 110.431 -178.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 21' ' ' LEU . . . . . 0.63 ' HA ' HD21 ' J' ' 3' ' ' LEU . 4.3 tt -59.81 -58.63 7.75 Favored 'General case' 0 CA--C 1.516 -0.364 0 C-N-CA 120.289 -0.565 . . . . 95.08 110.64 -177.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' I' I ' 22' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.26 -37.39 62.08 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.079 -1.049 . . . . 67.98 110.878 -168.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 23' ' ' LYS . . . . . . . . . . . . . 1.4 mttm -70.7 -44.85 66.11 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 119.279 -0.968 . . . . 63.86 110.79 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 24' ' ' TRP . . . . . . . . . . . . . 7.0 m-90 . . . . . 0 C--N 1.324 -0.54 0 C-N-CA 120.116 -0.634 . . . . 76.51 111.73 -176.6 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 1' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 CA--C 1.523 -0.095 0 CA-C-O 120.591 0.234 . . . . 80.18 110.463 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 2' ' ' LYS . . . . . . . . . . . . . . . -56.85 -6.87 0.38 Allowed 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.423 0.527 . . . . 73.33 112.423 175.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 3' ' ' LEU . . . . . 0.63 HD21 ' HA ' ' I' ' 21' ' ' LEU . 11.4 tp -36.44 -44.45 0.43 Allowed 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 124.587 1.155 . . . . 63.59 110.402 161.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 4' ' ' LEU . . . . . . . . . . . . . 2.4 mp -70.26 -43.09 71.22 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 119.667 -0.813 . . . . 72.63 111.583 -175.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.68 -41.96 98.27 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 119.186 -1.006 . . . . 68.18 110.369 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -53.93 -43.53 69.87 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.105 0.478 . . . . 60.6 110.613 172.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 7' ' ' LEU . . . . . . . . . . . . . 7.8 tt -58.33 -53.11 62.05 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.083 0.468 . . . . 59.64 110.818 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 8' ' ' ARG . . . . . . . . . . . . . . . -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.167 -0.47 . . . . 63.36 110.481 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 9' ' ' LYS . . . . . . . . . . . . . . . -66.86 -35.26 79.62 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 119.536 -0.866 . . . . 59.9 111.274 179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 10' ' ' LEU . . . . . 0.518 HD13 ' HA ' ' I' ' 14' ' ' LEU . 80.7 mt -62.21 -48.15 81.28 Favored 'General case' 0 CA--C 1.514 -0.417 0 C-N-CA 118.919 -1.112 . . . . 56.14 109.892 177.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 11' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.01 -43.25 73.48 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.18 0.514 . . . . 59.01 110.789 176.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.43 -52.51 57.75 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.397 -0.521 . . . . 72.92 110.531 -176.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 13' ' ' ALA . . . . . . . . . . . . . . . -53.94 -33.69 57.54 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.756 -0.377 . . . . 59.79 110.404 174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 14' ' ' LEU . . . . . 0.481 HD22 HD21 ' I' ' 14' ' ' LEU . 59.4 tp -65.22 -49.35 70.04 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.157 0.503 . . . . 60.64 110.86 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 15' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -66.39 -31.07 71.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 118.145 -1.422 . . . . 77.69 110.92 177.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 16' ' ' LYS . . . . . . . . . . . . . . . -61.5 -46.39 90.21 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-O 121.214 0.53 . . . . 65.88 110.335 177.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 17' ' ' ALA . . . . . . . . . . . . . . . -62.28 -37.31 85.01 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.333 -0.394 . . . . 62.99 111.333 173.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 18' ' ' ILE . . . . . . . . . . . . . . . -62.97 -48.02 90.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 CA-C-O 121.73 0.776 . . . . 70.63 109.976 -177.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 19' ' ' GLU . . . . . . . . . . . . . 6.1 pt-20 -73.07 -26.65 61.35 Favored 'General case' 0 C--N 1.325 -0.485 0 C-N-CA 119.595 -0.842 . . . . 125.02 111.3 -179.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 20' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' L' ' 3' ' ' LEU . 11.8 tp -63.45 -35.24 79.79 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 118.943 -1.103 . . . . 80.46 110.272 169.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 21' ' ' LEU . . . . . 0.648 ' O ' ' N ' ' J' ' 26' ' ' NH2 . 1.5 tt -64.38 -37.22 86.75 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.93 -0.708 . . . . 61.33 110.156 172.704 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 22' ' ' GLU . . . . . . . . . . . . . . . -59.16 -47.16 86.33 Favored 'General case' 0 C--N 1.326 -0.447 0 C-N-CA 119.835 -0.746 . . . . 79.64 110.567 175.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 tptp -73.59 -41.62 62.65 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.302 -0.559 . . . . 93.95 111.476 -173.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 24' ' ' TRP . . . . . 0.434 ' NE1' ' O ' ' J' ' 101' ' ' HOH . 5.0 m0 -82.65 -66.59 0.87 Allowed 'General case' 0 C--O 1.234 0.238 0 CA-C-O 121.095 0.474 . . . . 81.05 110.451 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' J' J ' 25' ' ' GLY . . . . . . . . . . . . . . . -90.95 -90.28 1.35 Allowed Glycine 0 N--CA 1.445 -0.744 0 N-CA-C 108.699 -1.761 . . . . 90.64 108.699 176.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' J' J ' 26' ' ' NH2 . . . . . 0.648 ' N ' ' O ' ' J' ' 21' ' ' LEU . . . . . . . . 0 C--N 1.328 -0.331 0 O-C-N 123.13 -0.041 . . . . 83.16 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 1' ' ' SER . . . . . 0.483 ' O ' ' HB2' ' K' ' 4' ' ' LEU . 5.1 p . . . . . 0 N--CA 1.454 -0.233 0 CA-C-O 121.333 0.587 . . . . 38.54 110.973 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 2' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' K' ' 2' ' ' LYS . 2.5 ttmt -77.85 -46.66 20.8 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 119.09 -1.044 . . . . 68.27 110.648 -174.457 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 3' ' ' LEU . . . . . 0.503 HD12 ' HB3' ' K' ' 6' ' ' LEU . 11.6 tp -59.45 -38.47 80.84 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 118.531 -1.268 . . . . 32.37 110.349 170.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 4' ' ' LEU . . . . . 0.51 ' HB3' ' HE ' ' K' ' 8' ' ' ARG . 4.7 mt -46.52 -61.59 1.75 Allowed 'General case' 0 CA--C 1.505 -0.787 0 C-N-CA 119.685 -0.806 . . . . 24.6 108.93 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 5' ' ' GLU . . . . . 0.455 ' HA ' ' HD2' ' K' ' 8' ' ' ARG . . . -50.73 -41.04 55.94 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.775 -0.648 . . . . 18.29 111.135 179.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 6' ' ' LEU . . . . . 0.503 ' HB3' HD12 ' K' ' 3' ' ' LEU . 3.0 tt -56.65 -44.93 81.81 Favored 'General case' 0 C--N 1.326 -0.421 0 C-N-CA 118.69 -1.204 . . . . 50.05 110.313 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.78 -44.55 85.46 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.078 0.466 . . . . 49.04 110.499 -177.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 8' ' ' ARG . . . . . 0.51 ' HE ' ' HB3' ' K' ' 4' ' ' LEU . 49.4 mtt180 -53.07 -59.6 4.34 Favored 'General case' 0 C--O 1.239 0.517 0 CA-C-N 115.907 -0.588 . . . . 64.3 110.693 177.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 9' ' ' LYS . . . . . 0.511 ' NZ ' ' OE1' ' I' ' 12' ' ' GLU . 15.7 mmtt -62.38 -30.26 71.07 Favored 'General case' 0 C--O 1.16 -3.652 0 O-C-N 121.379 -0.825 . . . . 28.23 112.727 179.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 10' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' K' ' 10' ' ' LEU . 2.4 tp -67.55 -53.43 28.46 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 119.748 -0.781 . . . . 67.34 110.541 179.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 11' ' ' LEU . . . . . 0.553 ' O ' ' NH2' ' M' ' 8' ' ' ARG . 33.4 mt -59.79 -38.3 81.51 Favored 'General case' 0 CA--C 1.51 -0.587 0 C-N-CA 120.842 -0.343 . . . . 28.24 110.677 -179.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 12' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -62.41 -50.61 70.83 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 119.683 -0.807 . . . . 55.73 110.553 177.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 13' ' ' ALA . . . . . 0.556 ' O ' HD13 ' I' ' 6' ' ' LEU . . . -53.97 -48.96 69.8 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 121.645 0.736 . . . . 41.57 110.793 176.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 14' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.68 -49.48 47.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.511 -0.768 . . . . 65.06 110.469 175.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 15' ' ' HIS . . . . . 0.781 ' HB2' ' NH2' ' M' ' 8' ' ' ARG . 2.2 t-80 -61.21 -36.42 79.85 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.784 -0.644 . . . . 83.72 110.999 -177.358 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 16' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -74.91 -34.04 62.11 Favored 'General case' 0 CA--C 1.511 -0.54 0 C-N-CA 118.047 -1.461 . . . . 63.63 111.123 -176.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 17' ' ' ALA . . . . . . . . . . . . . . . -55.49 -48.01 75.26 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 119.66 -0.816 . . . . 41.98 110.657 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 18' ' ' ILE . . . . . 0.702 HD12 ' HA ' ' K' ' 15' ' ' HIS . 47.2 mt -54.47 -48.72 69.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-O 121.356 0.598 . . . . 37.94 109.95 178.057 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' K' K ' 19' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -65.11 -33.21 75.48 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 122.088 -0.383 . . . . 63.95 111.731 -175.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 mt -71.56 -34.72 70.22 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 118.728 -1.189 . . . . 55.91 111.268 174.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 21' ' ' LEU . . . . . . . . . . . . . . . -66.82 -30.37 70.54 Favored 'General case' 0 C--O 1.234 0.276 0 C-N-CA 119.333 -0.947 . . . . 46.76 111.378 174.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 22' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -85.5 -8.5 58.31 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 112.738 0.644 . . . . 43.42 112.738 176.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 23' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -87.11 -25.45 24.12 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 120.724 -0.391 . . . . 62.86 111.358 162.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 24' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -123.64 36.6 4.6 Favored 'General case' 0 N--CA 1.457 -0.1 0 C-N-CA 122.937 0.495 . . . . 72.32 112.026 -172.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 25' ' ' GLY . . . . . . . . . . . . . . . 158.75 -126.16 1.63 Allowed Glycine 0 N--CA 1.448 -0.558 0 N-CA-C 110.898 -0.881 . . . . 56.93 110.898 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.299 0 O-C-N 123.524 0.19 . . . . 52.17 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 1' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.512 -0.511 0 CA-C-O 122.122 0.963 . . . . 72.55 110.954 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 2' ' ' LYS . . . . . 0.543 ' HD3' ' H ' ' L' ' 2' ' ' LYS . 0.0 OUTLIER -46.45 -37.35 7.62 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.031 -1.44 . . . . 67.64 108.612 166.24 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 3' ' ' LEU . . . . . 0.481 ' HA ' HD22 ' J' ' 20' ' ' LEU . 10.1 tp -57.91 -44.99 87.13 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.074 0.464 . . . . 92.57 110.723 173.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 4' ' ' LEU . . . . . . . . . . . . . 26.1 tp -63.3 -40.42 97.29 Favored 'General case' 0 CA--C 1.513 -0.471 0 C-N-CA 118.382 -1.327 . . . . 66.9 110.373 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.2 -42.29 94.8 Favored 'General case' 0 C--N 1.327 -0.398 0 C-N-CA 119.479 -0.889 . . . . 51.65 109.981 178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 6' ' ' LEU . . . . . 0.583 HD11 HD21 ' I' ' 6' ' ' LEU . 1.8 tm? -51.22 -49.53 60.89 Favored 'General case' 0 C--O 1.241 0.63 0 CA-C-O 121.75 0.786 . . . . 64.88 110.752 171.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 7' ' ' LEU . . . . . 0.469 HD23 HD23 ' L' ' 11' ' ' LEU . 8.2 tt -61.86 -45.28 94.47 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.528 -0.76 . . . . 63.83 111.163 -179.677 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 8' ' ' ARG . . . . . . . . . . . . . . . -63.94 -39.03 93.22 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 120.647 -0.421 . . . . 66.98 110.986 -176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 9' ' ' LYS . . . . . 0.714 ' NZ ' ' O ' ' L' ' 101' ' ' HOH . 35.6 mmtt -67.38 -37.47 83.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.657 -1.217 . . . . 65.2 110.234 176.879 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 10' ' ' LEU . . . . . . . . . . . . . 2.8 mt -55.98 -36.92 68.4 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.058 -1.057 . . . . 52.67 110.842 171.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 11' ' ' LEU . . . . . 0.469 HD23 HD23 ' L' ' 7' ' ' LEU . 3.0 mm? -61.92 -58.51 7.62 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.177 -0.465 . . . . 56.98 111.179 179.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -57.49 -33.16 67.73 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.784 -0.766 . . . . 62.41 110.511 -178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.65 68.23 Favored 'General case' 0 CA--C 1.516 -0.351 0 O-C-N 121.706 -0.621 . . . . 48.19 111.057 176.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 14' ' ' LEU . . . . . 0.514 HD21 HD22 ' M' ' 4' ' ' LEU . 4.4 tp -59.71 -34.17 72.57 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 120.412 -0.515 . . . . 75.76 111.017 178.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 15' ' ' HIS . . . . . 0.508 ' O ' HG12 ' L' ' 18' ' ' ILE . . . -58.09 -50.76 72.36 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.82 0.343 . . . . 58.62 110.197 173.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 16' ' ' LYS . . . . . . . . . . . . . 20.8 mmtt -66.94 -25.92 66.59 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 118.473 -1.291 . . . . 60.5 110.665 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.33 -58.22 5.8 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 119.956 -0.698 . . . . 51.3 110.515 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 18' ' ' ILE . . . . . 0.508 HG12 ' O ' ' L' ' 15' ' ' HIS . 2.8 pt -59.72 -23.06 25.13 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.641 0 O-C-N 121.956 -0.465 . . . . 71.58 110.067 178.295 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 19' ' ' GLU . . . . . 0.404 ' O ' ' HG3' ' L' ' 22' ' ' GLU . 0.3 OUTLIER -64.9 -48.6 73.62 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.004 0.43 . . . . 144.43 110.241 171.783 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' L' L ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 tp -56.22 -33.23 65.17 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.185 -0.606 . . . . 66.78 111.1 172.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.9 -18.51 33.9 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 113.559 0.948 . . . . 73.56 113.559 -171.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 22' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' L' ' 19' ' ' GLU . 3.0 mt-10 -81.03 -46.84 14.43 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 118.535 0.607 . . . . 112.51 112.576 -166.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' L' L ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tptt -54.14 -31.05 51.31 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 120.662 -0.415 . . . . 94.01 111.549 -174.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 24' ' ' TRP . . . . . . . . . . . . . 2.5 m-90 . . . . . 0 C--N 1.326 -0.45 0 C-N-CA 120.337 -0.545 . . . . 84.62 110.736 169.409 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' M' M ' 1' ' ' SER . . . . . 0.421 ' N ' ' O ' ' M' ' 203' ' ' HOH . 2.9 t . . . . . 0 CA--C 1.516 -0.355 0 CA-C-O 121.302 0.572 . . . . 53.85 110.102 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 2' ' ' LYS . . . . . . . . . . . . . 9.7 mmtt -123.22 -28.57 3.98 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.241 -0.89 . . . . 67.26 112.84 179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 3' ' ' LEU . . . . . . . . . . . . . . . -57.14 -41.2 78.68 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 119.604 -0.839 . . . . 58.07 110.686 168.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 4' ' ' LEU . . . . . 0.691 ' HA ' HD12 ' M' ' 7' ' ' LEU . 1.2 mt -67.61 -40.23 84.71 Favored 'General case' 0 CA--C 1.513 -0.457 0 C-N-CA 120.221 -0.592 . . . . 86.06 110.934 -178.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 5' ' ' GLU . . . . . 0.437 ' HA ' ' HE ' ' M' ' 8' ' ' ARG . . . -54.98 -43.55 73.63 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.542 -0.463 . . . . 53.89 110.894 171.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 6' ' ' LEU . . . . . . . . . . . . . 4.8 tp -59.33 -43.84 92.68 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.396 -0.522 . . . . 36.43 111.165 175.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 7' ' ' LEU . . . . . 0.691 HD12 ' HA ' ' M' ' 4' ' ' LEU . 5.8 mt -55.49 -49.36 72.75 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 119.92 -0.712 . . . . 38.29 110.828 177.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 8' ' ' ARG . . . . . 0.781 ' NH2' ' HB2' ' K' ' 15' ' ' HIS . 0.1 OUTLIER -68.14 -43.14 78.97 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 118.881 -1.128 . . . . 42.19 111.465 -173.614 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' M' M ' 9' ' ' LYS . . . . . . . . . . . . . 54.1 mmtt -61.13 -37.0 81.26 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 117.47 -1.692 . . . . 43.96 110.267 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 10' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' N' ' 14' ' ' LEU . 26.7 tp -60.89 -57.85 10.9 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.354 -0.538 . . . . 38.79 110.264 178.584 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 mt -65.82 -26.38 67.65 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 119.438 -0.905 . . . . 36.09 112.024 -176.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 12' ' ' GLU . . . . . 0.604 ' O ' ' HG2' ' M' ' 16' ' ' LYS . 21.5 mt-10 -70.17 -43.34 71.02 Favored 'General case' 0 C--O 1.178 -2.692 0 CA-C-N 120.065 1.302 . . . . 53.54 108.924 176.555 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.65 -41.87 77.94 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 119.855 -0.738 . . . . 42.54 109.764 170.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 14' ' ' LEU . . . . . 0.606 ' O ' HG13 ' M' ' 18' ' ' ILE . 4.2 tp -62.0 -47.84 82.99 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.789 -0.641 . . . . 42.91 110.429 -178.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 15' ' ' HIS . . . . . 0.541 ' HA ' HD12 ' M' ' 18' ' ' ILE . 2.5 t-80 -62.28 -39.08 91.76 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.388 -0.369 . . . . 44.82 110.98 -178.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 16' ' ' LYS . . . . . 0.604 ' HG2' ' O ' ' M' ' 12' ' ' GLU . 40.8 mmtm -67.23 -39.02 86.18 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 118.708 -1.197 . . . . 74.98 110.328 177.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 17' ' ' ALA . . . . . 0.494 ' HB1' ' HG ' ' N' ' 7' ' ' LEU . . . -57.42 -41.88 81.26 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 119.946 -0.702 . . . . 41.49 110.358 174.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 18' ' ' ILE . . . . . 0.606 HG13 ' O ' ' M' ' 14' ' ' LEU . 24.3 mt -55.14 -63.84 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 109.301 -0.629 . . . . 46.32 109.301 174.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 19' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -48.17 -38.67 18.67 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.317 -0.553 . . . . 40.39 111.447 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 20' ' ' LEU . . . . . 0.581 ' HB3' HD11 ' N' ' 3' ' ' LEU . 6.9 mt -64.64 -50.19 68.06 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.959 -0.696 . . . . 36.45 110.49 -179.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' M' M ' 21' ' ' LEU . . . . . . . . . . . . . . . -62.45 -30.55 71.32 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.994 -0.682 . . . . 67.38 111.376 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 22' ' ' GLU . . . . . . . . . . . . . 84.7 mt-10 -73.26 -33.56 65.34 Favored 'General case' 0 C--N 1.324 -0.514 0 C-N-CA 119.818 -0.753 . . . . 52.99 110.718 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.58 -25.02 38.77 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 119.076 -1.049 . . . . 69.84 112.289 174.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 24' ' ' TRP . . . . . . . . . . . . . 10.1 m95 -106.85 9.08 31.0 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 113.53 0.937 . . . . 58.22 113.53 -173.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.04 -96.82 0.23 Allowed Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.512 -0.851 . . . . 80.71 112.108 176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 26' ' ' NH2 . . . . . 0.645 ' N ' ' O ' ' M' ' 202' ' ' HOH . . . . . . . . 0 C--N 1.329 -0.287 0 O-C-N 122.927 -0.16 . . . . 76.18 . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 1' ' ' SER . . . . . . . . . . . . . 4.0 t . . . . . 0 CA--C 1.522 -0.127 0 CA-C-O 121.424 0.63 . . . . 64.74 110.242 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' N' N ' 2' ' ' LYS . . . . . . . . . . . . . . . -91.19 -10.46 41.62 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.192 -0.913 . . . . 63.24 112.553 174.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 3' ' ' LEU . . . . . 0.581 HD11 ' HB3' ' M' ' 20' ' ' LEU . 1.3 tt -49.93 -44.72 50.56 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.342 0.591 . . . . 76.19 109.874 169.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 4' ' ' LEU . . . . . . . . . . . . . . . -63.54 -45.73 89.21 Favored 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 119.999 -0.681 . . . . 65.17 110.678 -178.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.3 -41.25 96.66 Favored 'General case' 0 CA--C 1.514 -0.407 0 C-N-CA 119.745 -0.782 . . . . 58.6 110.091 -178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 6' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.94 -42.07 93.22 Favored 'General case' 0 C--N 1.326 -0.422 0 C-N-CA 120.495 -0.482 . . . . 52.29 110.602 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 7' ' ' LEU . . . . . 0.494 ' HG ' ' HB1' ' M' ' 17' ' ' ALA . 2.0 mt -57.96 -53.47 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-O 121.01 0.433 . . . . 57.85 110.706 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.08 -43.36 61.01 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-N 116.087 -0.506 . . . . 67.88 110.939 177.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 9' ' ' LYS . . . . . . . . . . . . . . . -71.61 -44.55 64.21 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.239 -0.584 . . . . 57.6 111.281 -174.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 10' ' ' LEU . . . . . 0.573 ' HB3' HD13 ' M' ' 14' ' ' LEU . 11.1 mt -55.45 -43.0 75.04 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 119.484 -0.887 . . . . 63.6 109.94 173.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 11' ' ' LEU . . . . . 0.446 HD12 ' O ' ' N' ' 7' ' ' LEU . 2.7 mt -59.05 -44.63 91.83 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.105 0.479 . . . . 64.06 111.209 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 12' ' ' GLU . . . . . . . . . . . . . . . -66.44 -45.57 79.38 Favored 'General case' 0 C--O 1.241 0.631 0 C-N-CA 119.837 -0.745 . . . . 78.82 110.585 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 13' ' ' ALA . . . . . 0.54 ' HA ' ' HE3' ' P' ' 9' ' ' LYS . . . -50.78 -38.69 49.73 Favored 'General case' 0 CA--C 1.513 -0.465 0 C-N-CA 120.563 -0.455 . . . . 61.16 109.941 171.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 14' ' ' LEU . . . . . 0.425 ' HA ' HD21 ' M' ' 10' ' ' LEU . 3.3 tm? -67.23 -41.54 85.5 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 120.512 -0.475 . . . . 62.0 110.508 -179.16 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 15' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.51 -51.21 70.4 Favored 'General case' 0 CA--C 1.512 -0.499 0 C-N-CA 119.997 -0.681 . . . . 62.84 110.351 177.575 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 16' ' ' LYS . . . . . 0.448 ' HA ' ' HG2' ' N' ' 19' ' ' GLU . . . -65.41 -37.7 87.73 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 120.308 -0.557 . . . . 65.71 111.021 -176.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.38 -47.88 83.76 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 120.011 -0.675 . . . . 57.23 110.174 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 18' ' ' ILE . . . . . . . . . . . . . 3.6 mt -55.3 -44.68 76.28 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.64 0 CA-C-O 121.431 0.634 . . . . 59.58 109.878 -179.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HG2' ' N' ' 22' ' ' GLU . 10.3 pt-20 -82.95 -29.81 28.8 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 117.737 -1.585 . . . . 77.38 112.0 -172.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 20' ' ' LEU . . . . . . . . . . . . . 2.2 mt -64.37 -31.75 73.09 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 118.548 -1.261 . . . . 71.85 109.796 170.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' N' N ' 21' ' ' LEU . . . . . 0.508 HD22 HD11 ' M' ' 7' ' ' LEU . 13.1 tp -66.38 -41.99 88.59 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 120.731 0.3 . . . . 68.05 110.752 172.353 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 22' ' ' GLU . . . . . 0.61 ' HG2' ' HA ' ' N' ' 19' ' ' GLU . 11.4 mm-40 -55.91 -41.18 74.16 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.475 -0.49 . . . . 77.26 110.398 173.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 23' ' ' LYS . . . . . 0.549 ' NZ ' ' OG ' ' P' ' 1' ' ' SER . 25.5 ttpt -58.99 -63.8 1.17 Allowed 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.914 0.388 . . . . 82.71 110.56 174.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' N' N ' 24' ' ' TRP . . . . . 0.425 ' HE3' ' HG2' ' N' ' 23' ' ' LYS . 1.1 p90 . . . . . 0 C--N 1.331 -0.212 0 CA-C-O 120.848 0.356 . . . . 94.79 110.685 173.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 1' ' ' SER . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.513 -0.457 0 N-CA-C 109.14 -0.689 . . . . 45.81 109.14 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' O' O ' 2' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -121.84 -56.22 1.86 Allowed 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 112.593 0.59 . . . . 52.7 112.593 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 3' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -69.23 -45.34 70.04 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 120.273 -1.517 . . . . 40.54 110.557 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 4' ' ' LEU . . . . . . . . . . . . . 85.3 mt -60.29 -33.07 71.82 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.562 -0.855 . . . . 46.24 111.161 -179.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 5' ' ' GLU . . . . . 0.455 ' CD ' HH21 ' O' ' 8' ' ' ARG . 3.6 mm-40 -78.05 -28.69 49.02 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 117.932 -1.507 . . . . 37.17 111.364 178.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 6' ' ' LEU . . . . . 0.406 HD23 ' N ' ' O' ' 7' ' ' LEU . 1.8 tt -53.52 -46.2 70.03 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 118.452 -1.299 . . . . 37.57 109.721 163.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 7' ' ' LEU . . . . . 0.406 ' N ' HD23 ' O' ' 6' ' ' LEU . 65.3 tp -60.38 -47.2 87.11 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.275 -0.875 . . . . 50.22 110.517 -176.822 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 8' ' ' ARG . . . . . 0.455 HH21 ' CD ' ' O' ' 5' ' ' GLU . 29.2 ttp85 -46.74 -53.91 10.82 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.821 -0.627 . . . . 48.47 111.966 173.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 9' ' ' LYS . . . . . . . . . . . . . 57.7 mttm -71.94 -30.18 65.06 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 117.674 -1.611 . . . . 40.24 111.137 -172.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 10' ' ' LEU . . . . . . . . . . . . . 10.7 tp -62.75 -49.56 74.53 Favored 'General case' 0 C--N 1.326 -0.426 0 C-N-CA 118.707 -1.197 . . . . 35.12 110.484 172.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 11' ' ' LEU . . . . . 0.584 ' HB3' ' HG2' ' Q' ' 8' ' ' ARG . 38.0 mt -58.64 -39.57 80.93 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.25 -0.58 . . . . 42.1 110.63 -179.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 12' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -67.17 -41.81 85.33 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.382 -0.527 . . . . 38.1 110.958 -179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.1 -41.98 89.38 Favored 'General case' 0 CA--C 1.515 -0.371 0 C-N-CA 120.116 -0.634 . . . . 38.93 110.031 175.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 14' ' ' LEU . . . . . . . . . . . . . 4.1 tp -64.25 -38.44 91.04 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.225 -0.443 . . . . 42.46 110.942 177.316 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 15' ' ' HIS . . . . . . . . . . . . . 20.9 t-160 -56.06 -46.57 78.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.776 0.322 . . . . 51.04 110.429 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 16' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -78.34 -31.26 48.53 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 118.806 -1.157 . . . . 51.67 112.3 -174.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 17' ' ' ALA . . . . . . . . . . . . . . . -58.14 -51.92 67.7 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 119.918 -0.713 . . . . 48.3 110.162 169.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 18' ' ' ILE . . . . . 0.438 HD13 ' HA ' ' O' ' 18' ' ' ILE . 5.0 mm -46.5 -57.65 0.95 Allowed 'Isoleucine or valine' 0 CA--C 1.518 -0.257 0 N-CA-C 109.697 -0.482 . . . . 36.07 109.697 172.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 19' ' ' GLU . . . . . . . . . . . . . . . -46.74 -64.28 0.81 Allowed 'General case' 0 CA--C 1.515 -0.384 0 C-N-CA 123.487 0.715 . . . . 44.08 111.386 -176.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 20' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.8 -13.41 61.68 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 115.893 -2.323 . . . . 53.12 112.413 -174.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' O' O ' 21' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -64.23 -46.46 83.72 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 119.072 -1.051 . . . . 53.96 109.764 165.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 22' ' ' GLU . . . . . . . . . . . . . 77.5 mt-10 -81.38 46.49 0.95 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 109.0 -0.741 . . . . 55.96 109.0 -173.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 23' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -134.63 -22.52 1.67 Allowed 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.952 -0.567 . . . . 63.86 112.462 157.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 24' ' ' TRP . . . . . . . . . . . . . . . -95.89 75.79 3.14 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-O 122.366 1.079 . . . . 66.74 108.355 177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 25' ' ' GLY . . . . . . . . . . . . . . . 61.95 54.1 37.77 Favored Glycine 0 N--CA 1.447 -0.574 0 N-CA-C 110.327 -1.109 . . . . 77.39 110.327 -174.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' O' O ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.988 -0.106 . . . . 71.94 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 1' ' ' SER . . . . . 0.549 ' OG ' ' NZ ' ' N' ' 23' ' ' LYS . 1.4 t . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 121.36 0.6 . . . . 63.97 110.341 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 2' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -74.96 -5.52 44.33 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 79.57 112.385 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 3' ' ' LEU . . . . . 0.582 HD12 ' H ' ' P' ' 3' ' ' LEU . 5.1 mp -53.7 -40.19 65.82 Favored 'General case' 0 CA--C 1.512 -0.482 0 CA-C-O 120.746 0.307 . . . . 67.85 110.578 169.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 4' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -61.22 -52.67 63.8 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.75 -0.38 . . . . 71.05 111.007 -179.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.51 -39.43 83.84 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.763 -0.775 . . . . 63.03 110.599 178.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 6' ' ' LEU . . . . . . . . . . . . . 7.5 tp -59.51 -42.67 92.75 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 119.582 -0.847 . . . . 59.74 110.511 178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 7' ' ' LEU . . . . . 0.709 ' HA ' HD12 ' P' ' 10' ' ' LEU . . . -63.63 -44.1 94.89 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-O 120.939 0.399 . . . . 58.45 110.709 179.409 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 8' ' ' ARG . . . . . . . . . . . . . . . -53.24 -45.05 68.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.141 0.496 . . . . 63.73 110.301 175.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 9' ' ' LYS . . . . . 0.54 ' HE3' ' HA ' ' N' ' 13' ' ' ALA . 4.9 mtmt -60.53 -49.4 77.71 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.169 0.509 . . . . 92.67 111.135 179.473 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 10' ' ' LEU . . . . . 0.709 HD12 ' HA ' ' P' ' 7' ' ' LEU . 4.5 mt -53.6 -49.87 66.86 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 119.735 -0.786 . . . . 67.16 109.835 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 11' ' ' LEU . . . . . . . . . . . . . 5.6 tp -61.56 -37.9 85.53 Favored 'General case' 0 CA--C 1.509 -0.6 0 C-N-CA 119.797 -0.761 . . . . 64.04 110.548 -178.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 12' ' ' GLU . . . . . . . . . . . . . . . -57.46 -60.31 3.85 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 119.673 -0.811 . . . . 67.9 110.076 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 13' ' ' ALA . . . . . . . . . . . . . . . -51.25 -34.51 32.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.152 -0.476 . . . . 72.87 110.296 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 14' ' ' LEU . . . . . 0.631 HD13 HD11 ' P' ' 18' ' ' ILE . 1.8 tm? -64.37 -48.13 76.65 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.082 -0.508 . . . . 64.71 110.764 177.627 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 15' ' ' HIS . . . . . 0.665 ' HA ' HD12 ' P' ' 18' ' ' ILE . . . -57.26 -41.2 79.21 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 120.531 -0.468 . . . . 61.14 110.642 178.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 16' ' ' LYS . . . . . . . . . . . . . . . -64.59 -46.6 82.0 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-O 121.2 0.524 . . . . 52.59 110.75 -179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 17' ' ' ALA . . . . . . . . . . . . . . . -45.25 -55.73 5.56 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 119.835 -0.746 . . . . 59.72 110.223 168.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 18' ' ' ILE . . . . . 0.665 HD12 ' HA ' ' P' ' 15' ' ' HIS . 14.8 mt -58.97 -35.9 59.12 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.603 0 CA-C-O 121.188 0.518 . . . . 82.12 110.515 -174.117 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 19' ' ' GLU . . . . . . . . . . . . . . . -60.74 -43.78 97.5 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 119.947 -0.701 . . . . 54.45 110.08 177.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 20' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.51 -45.9 90.38 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 118.847 -1.141 . . . . 66.91 109.985 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -50.35 -35.96 30.13 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.219 0.533 . . . . 80.08 111.213 174.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.81 -55.51 5.42 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 121.327 0.584 . . . . 73.98 110.392 -172.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.42 -23.96 64.69 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.774 -0.771 . . . . 70.26 111.655 -178.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 24' ' ' TRP . . . . . . . . . . . . . 2.1 m95 . . . . . 0 C--N 1.325 -0.461 0 CA-C-N 118.075 0.398 . . . . 74.49 110.842 -174.377 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 1' ' ' SER . . . . . . . . . . . . . 2.2 t . . . . . 0 CA--C 1.515 -0.395 0 N-CA-C 109.266 -0.642 . . . . 58.84 109.266 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 2' ' ' LYS . . . . . . . . . . . . . 35.9 mttt -51.42 -28.76 13.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.507 -0.77 . . . . 56.44 110.777 171.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 3' ' ' LEU . . . . . 0.579 ' O ' ' HG ' ' Q' ' 6' ' ' LEU . 40.7 tp -61.44 -52.02 66.31 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.293 0.568 . . . . 40.16 111.403 172.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 4' ' ' LEU . . . . . 0.481 ' O ' ' HG3' ' Q' ' 8' ' ' ARG . 3.4 mt -61.32 -40.91 95.95 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 119.545 -0.862 . . . . 55.68 110.808 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 5' ' ' GLU . . . . . . . . . . . . . . . -53.12 -48.29 67.99 Favored 'General case' 0 C--O 1.241 0.606 0 CA-C-O 121.125 0.488 . . . . 44.75 111.487 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 6' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' Q' ' 3' ' ' LEU . 1.9 pp -67.95 -35.37 78.29 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 117.695 -1.602 . . . . 47.68 111.108 -178.455 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 7' ' ' LEU . . . . . . . . . . . . . 33.3 tp -53.54 -43.15 68.16 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 118.88 -1.128 . . . . 35.94 109.864 172.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 8' ' ' ARG . . . . . 0.584 ' HG2' ' HB3' ' O' ' 11' ' ' LEU . 8.6 mtm-85 -59.26 -54.4 47.31 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 116.149 -0.478 . . . . 54.15 111.113 179.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 9' ' ' LYS . . . . . 0.771 ' HD3' ' HD3' ' S' ' 9' ' ' LYS . 26.2 mmtt -62.86 -33.88 76.2 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 117.907 -1.517 . . . . 41.75 110.328 -175.238 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 10' ' ' LEU . . . . . 0.426 ' CD1' HD12 ' R' ' 10' ' ' LEU . 15.2 tp -59.18 -43.2 92.16 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 119.494 -0.882 . . . . 44.26 110.634 172.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 11' ' ' LEU . . . . . . . . . . . . . 11.1 mt -69.94 -40.91 75.19 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.065 -1.054 . . . . 35.71 110.91 -173.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 12' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -62.98 -34.89 78.49 Favored 'General case' 0 CA--C 1.511 -0.55 0 C-N-CA 119.574 -0.851 . . . . 63.7 110.072 176.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.87 -50.68 65.63 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.012 -0.675 . . . . 46.45 110.678 175.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 14' ' ' LEU . . . . . 0.578 HD13 ' HB2' ' R' ' 10' ' ' LEU . 2.8 tp -56.38 -40.62 74.89 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 121.334 0.588 . . . . 44.84 110.086 179.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 15' ' ' HIS . . . . . 0.454 ' O ' ' HB ' ' Q' ' 18' ' ' ILE . 20.5 t-80 -69.56 -31.87 70.31 Favored 'General case' 0 N--CA 1.44 -0.925 0 C-N-CA 119.479 -0.888 . . . . 47.96 110.924 -177.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tptt -75.35 -27.46 59.18 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 117.662 -1.615 . . . . 48.2 111.32 178.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.52 -41.74 88.35 Favored 'General case' 0 C--O 1.242 0.671 0 C-N-CA 119.309 -0.956 . . . . 46.44 110.477 170.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 18' ' ' ILE . . . . . 0.454 ' HB ' ' O ' ' Q' ' 15' ' ' HIS . 45.3 mt -47.05 -57.16 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.239 0.532 0 CA-C-O 121.587 0.708 . . . . 41.07 109.501 170.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 19' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -61.26 -30.82 70.7 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 116.012 -0.54 . . . . 66.58 112.053 -176.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 20' ' ' LEU . . . . . . . . . . . . . 10.9 mt -70.35 -37.25 74.6 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.457 -0.897 . . . . 51.35 111.114 179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 21' ' ' LEU . . . . . . . . . . . . . 6.7 tp -63.55 -42.36 98.39 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.346 -0.942 . . . . 70.01 110.627 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 22' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -58.67 -37.66 76.5 Favored 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 119.784 -0.766 . . . . 51.53 111.208 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 23' ' ' LYS . . . . . 0.63 ' HG2' ' CD1' ' Q' ' 24' ' ' TRP . 8.4 ttpt -77.53 -64.81 1.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 118.995 -1.082 . . . . 64.97 111.242 179.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 24' ' ' TRP . . . . . 0.63 ' CD1' ' HG2' ' Q' ' 23' ' ' LYS . 28.1 m0 -86.31 48.33 1.6 Allowed 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 120.386 -0.526 . . . . 80.55 110.956 -178.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Q' Q ' 25' ' ' GLY . . . . . . . . . . . . . . . -120.69 -81.04 0.63 Allowed Glycine 0 N--CA 1.448 -0.549 0 C-N-CA 121.445 -0.407 . . . . 65.15 112.319 173.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.064 -0.068 . . . . 62.62 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' R' R ' 1' ' ' SER . . . . . 0.621 ' HG ' ' HZ3' ' T' ' 24' ' ' TRP . 4.6 t . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.219 0.533 . . . . 68.05 111.972 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 2' ' ' LYS . . . . . 0.403 ' N ' ' OG ' ' R' ' 1' ' ' SER . 8.5 mmtm -70.89 2.52 4.21 Favored 'General case' 0 C--O 1.238 0.448 0 N-CA-C 113.73 1.011 . . . . 63.27 113.73 -169.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 3' ' ' LEU . . . . . . . . . . . . . 2.5 mp -60.55 -26.96 67.29 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.269 -0.972 . . . . 54.69 111.098 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 4' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.94 -39.9 55.15 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 119.09 -1.044 . . . . 65.75 111.086 -179.067 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.02 -42.48 76.55 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.406 -0.918 . . . . 65.13 110.283 167.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 6' ' ' LEU . . . . . 0.549 HD23 ' HB3' ' T' ' 16' ' ' LYS . 2.1 tm? -57.57 -47.52 81.86 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.202 0.525 . . . . 52.09 111.383 177.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 7' ' ' LEU . . . . . 1.0 ' O ' HD12 ' R' ' 11' ' ' LEU . . . -60.96 -50.56 72.91 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 120.975 0.416 . . . . 53.68 110.747 -178.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 8' ' ' ARG . . . . . 0.546 ' HA ' ' CD1' ' R' ' 11' ' ' LEU . . . -51.7 -38.12 53.7 Favored 'General case' 0 C--O 1.241 0.63 0 C-N-CA 120.402 -0.519 . . . . 86.98 111.04 175.639 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 9' ' ' LYS . . . . . . . . . . . . . . . -61.31 -54.42 44.16 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 120.365 -0.534 . . . . 77.43 110.693 -179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 10' ' ' LEU . . . . . 0.578 ' HB2' HD13 ' Q' ' 14' ' ' LEU . 2.3 mm? -55.5 -35.08 65.21 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 118.716 -1.194 . . . . 50.24 110.474 177.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 11' ' ' LEU . . . . . 1.0 HD12 ' O ' ' R' ' 7' ' ' LEU . 1.0 OUTLIER -65.54 -53.62 39.54 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.184 -0.606 . . . . 45.93 110.976 -173.494 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' R' R ' 12' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -67.39 -29.36 68.85 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 118.591 -1.244 . . . . 80.61 110.29 -179.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.59 -36.43 80.66 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 118.962 -1.095 . . . . 57.09 110.714 173.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 14' ' ' LEU . . . . . . . . . . . . . 2.5 tt -69.45 -46.6 66.33 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 120.896 0.379 . . . . 49.77 110.984 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 15' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -43.71 -44.64 6.65 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 109.35 -0.611 . . . . 69.31 109.35 168.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 16' ' ' LYS . . . . . . . . . . . . . . . -66.58 -47.97 71.06 Favored 'General case' 0 CA--C 1.519 -0.243 0 CA-C-O 120.902 0.382 . . . . 45.32 111.439 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 17' ' ' ALA . . . . . 0.445 ' O ' HD12 ' R' ' 21' ' ' LEU . . . -56.78 -39.58 74.33 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 119.42 -0.912 . . . . 62.13 110.855 175.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 18' ' ' ILE . . . . . 0.589 ' HA ' HD12 ' R' ' 21' ' ' LEU . . . -64.62 -51.2 70.56 Favored 'Isoleucine or valine' 0 C--O 1.238 0.455 0 CA-C-O 121.202 0.525 . . . . 53.24 110.217 -179.072 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 19' ' ' GLU . . . . . . . . . . . . . 54.7 tt0 -57.1 -29.51 63.58 Favored 'General case' 0 CA--C 1.515 -0.4 0 CA-C-N 116.541 -0.3 . . . . 87.01 110.58 176.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.4 HD12 HD21 ' Q' ' 3' ' ' LEU . 1.6 tm? -62.68 -57.37 11.27 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.214 -0.594 . . . . 62.9 109.954 172.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 21' ' ' LEU . . . . . 0.589 HD12 ' HA ' ' R' ' 18' ' ' ILE . 1.2 mt -47.28 -32.16 4.41 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 116.129 -0.487 . . . . 80.74 111.29 177.275 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 22' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -73.73 -64.66 0.95 Allowed 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.553 -0.459 . . . . 78.26 111.278 176.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 23' ' ' LYS . . . . . . . . . . . . . . . -68.0 -58.79 3.95 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.955 0.407 . . . . 91.37 110.956 -169.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 24' ' ' TRP . . . . . 0.46 ' HH2' ' H3 ' ' T' ' 1' ' ' SER . 11.0 m0 -83.59 54.81 2.97 Favored 'General case' 0 N--CA 1.452 -0.333 0 N-CA-C 106.93 -1.507 . . . . 87.58 106.93 172.685 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' R' R ' 25' ' ' GLY . . . . . . . . . . . . . . . -150.03 140.72 8.22 Favored Glycine 0 N--CA 1.446 -0.687 0 N-CA-C 108.602 -1.799 . . . . 64.69 108.602 172.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' R' R ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.053 -0.073 . . . . 57.31 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' S' S ' 1' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 CA--C 1.507 -0.68 0 N-CA-C 107.965 -1.124 . . . . 63.53 107.965 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' S' S ' 2' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.55 -45.51 85.03 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 114.014 -1.448 . . . . 57.98 111.089 -176.404 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 3' ' ' LEU . . . . . . . . . . . . . 4.2 tp -69.88 -38.55 76.42 Favored 'General case' 0 C--O 1.24 0.585 0 C-N-CA 119.896 -0.722 . . . . 46.52 112.061 -176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 4' ' ' LEU . . . . . . . . . . . . . 16.7 mt -63.27 -36.45 83.72 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 119.283 -0.967 . . . . 42.4 110.36 176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.61 -37.68 87.23 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.76 -0.776 . . . . 38.96 110.94 173.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 6' ' ' LEU . . . . . . . . . . . . . 3.6 tt -59.51 -55.37 35.41 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.63 0.729 . . . . 43.84 110.453 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 7' ' ' LEU . . . . . . . . . . . . . 24.7 tp -55.2 -37.34 66.97 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.795 -0.639 . . . . 42.9 110.156 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 8' ' ' ARG . . . . . 0.494 ' NH2' ' O ' ' S' ' 101' ' ' HOH . 38.9 ttp180 -60.27 -57.48 12.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 114.135 1.161 . . . . 52.28 114.135 -179.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 9' ' ' LYS . . . . . 0.771 ' HD3' ' HD3' ' Q' ' 9' ' ' LYS . 11.3 mmtt -69.4 -28.09 65.86 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 119.809 -0.757 . . . . 48.63 111.085 -178.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 10' ' ' LEU . . . . . 0.563 HD21 ' HA ' ' T' ' 14' ' ' LEU . 4.9 tp -65.75 -45.93 80.76 Favored 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 119.625 -0.83 . . . . 47.93 110.724 173.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 11' ' ' LEU . . . . . . . . . . . . . 6.1 mt -59.13 -43.92 92.0 Favored 'General case' 0 CA--C 1.512 -0.484 0 C-N-CA 120.094 -0.642 . . . . 47.14 110.568 177.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 12' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -59.84 -42.98 94.79 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.87 -0.732 . . . . 52.65 110.233 178.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 13' ' ' ALA . . . . . . . . . . . . . . . -59.74 -44.27 93.86 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 120.028 -0.669 . . . . 53.47 110.255 177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 14' ' ' LEU . . . . . 0.586 HD12 ' HB3' ' T' ' 10' ' ' LEU . 1.3 tt -63.25 -42.3 99.18 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 120.59 -0.444 . . . . 43.79 110.964 -179.775 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 15' ' ' HIS . . . . . 0.789 ' HA ' HD12 ' S' ' 18' ' ' ILE . 18.0 t60 -59.95 -40.05 87.68 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.952 0.406 . . . . 58.94 110.226 179.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 16' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -67.69 -33.38 74.8 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.997 -1.081 . . . . 74.69 111.253 175.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.19 -43.96 98.05 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.718 -0.793 . . . . 45.84 110.703 174.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 18' ' ' ILE . . . . . 0.789 HD12 ' HA ' ' S' ' 15' ' ' HIS . 24.0 mt -53.88 -51.31 46.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 109.634 -0.506 . . . . 53.64 109.634 175.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 19' ' ' GLU . . . . . 0.521 ' HG3' ' O ' ' S' ' 15' ' ' HIS . 21.3 mt-10 -57.4 -42.83 83.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.973 -1.091 . . . . 64.26 111.4 -179.145 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.46 HD23 ' HA ' ' S' ' 20' ' ' LEU . 7.5 mt -69.66 -46.75 65.4 Favored 'General case' 0 C--N 1.324 -0.541 0 C-N-CA 119.132 -1.027 . . . . 57.35 110.81 -174.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 21' ' ' LEU . . . . . 0.558 HD13 HD12 ' T' ' 3' ' ' LEU . 4.8 tp -51.63 -48.48 63.29 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.201 0.524 . . . . 66.08 110.495 174.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' S' S ' 22' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -65.43 -45.27 84.52 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 119.385 -0.926 . . . . 75.77 110.764 -173.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 23' ' ' LYS . . . . . . . . . . . . . 4.0 tptt -76.41 -64.83 1.02 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 118.632 -1.227 . . . . 57.55 111.769 -176.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 24' ' ' TRP . . . . . . . . . . . . . 13.5 m0 . . . . . 0 C--N 1.323 -0.571 0 C-N-CA 119.478 -0.889 . . . . 66.97 109.699 -176.792 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' T' T ' 1' ' ' SER . . . . . 0.46 ' H3 ' ' HH2' ' R' ' 24' ' ' TRP . 18.9 t . . . . . 0 C--O 1.236 0.362 0 CA-C-O 121.034 0.445 . . . . 63.24 111.013 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 2' ' ' LYS . . . . . 0.423 ' N ' ' OG ' ' T' ' 1' ' ' SER . . . -78.32 -4.73 49.5 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.025 0.75 . . . . 61.89 113.025 -177.002 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 3' ' ' LEU . . . . . 0.558 HD12 HD13 ' S' ' 21' ' ' LEU . 1.6 tm? -57.7 -39.18 76.6 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 119.982 -0.687 . . . . 61.48 110.597 175.262 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 4' ' ' LEU . . . . . . . . . . . . . 22.2 tp -65.78 -42.9 90.2 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 118.744 -1.182 . . . . 77.83 110.701 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 5' ' ' GLU . . . . . . . . . . . . . . . -60.69 -43.62 97.5 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.508 -0.877 . . . . 71.41 110.486 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 6' ' ' LEU . . . . . 0.483 HD23 HD22 ' T' ' 3' ' ' LEU . 6.7 tp -62.29 -40.16 95.37 Favored 'General case' 0 C--O 1.238 0.487 0 CA-C-O 121.126 0.489 . . . . 53.38 111.146 179.31 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -61.41 -51.4 68.93 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 116.412 -0.358 . . . . 70.13 110.48 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 8' ' ' ARG . . . . . . . . . . . . . . . -51.61 -36.06 44.25 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 120.6 -0.44 . . . . 77.0 110.524 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 9' ' ' LYS . . . . . . . . . . . . . . . -65.53 -52.84 49.63 Favored 'General case' 0 C--O 1.24 0.558 0 CA-C-O 121.061 0.458 . . . . 86.43 111.041 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 10' ' ' LEU . . . . . 0.586 ' HB3' HD12 ' S' ' 14' ' ' LEU . 2.5 mt -52.7 -40.51 63.05 Favored 'General case' 0 CA--C 1.512 -0.501 0 C-N-CA 119.776 -0.77 . . . . 72.89 109.804 176.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 tp -65.88 -49.22 68.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.021 -0.536 . . . . 52.97 110.535 -173.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 12' ' ' GLU . . . . . . . . . . . . . . . -64.51 -40.2 95.19 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.473 -0.491 . . . . 63.03 110.79 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.03 -38.5 70.64 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.566 -0.854 . . . . 61.43 110.328 173.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 14' ' ' LEU . . . . . 0.737 ' O ' HG12 ' T' ' 18' ' ' ILE . 2.2 tt -67.06 -43.83 81.67 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 120.739 -0.384 . . . . 71.44 111.252 179.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 15' ' ' HIS . . . . . 0.4 ' HD1' ' C ' ' T' ' 15' ' ' HIS . 0.5 OUTLIER -53.2 -45.4 68.59 Favored 'General case' 0 CA--C 1.508 -0.636 0 C-N-CA 119.505 -0.878 . . . . 78.68 109.737 174.112 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' T' T ' 16' ' ' LYS . . . . . 0.549 ' HB3' HD23 ' R' ' 6' ' ' LEU . 3.2 mptt -59.02 -45.84 89.7 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.276 0.56 . . . . 80.0 110.474 -178.794 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.12 -48.52 81.29 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.154 -0.618 . . . . 69.5 110.999 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 18' ' ' ILE . . . . . 0.737 HG12 ' O ' ' T' ' 14' ' ' LEU . 3.7 mm -69.05 -35.89 71.01 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.424 0 C-N-CA 118.699 -1.2 . . . . 67.06 110.649 -174.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 19' ' ' GLU . . . . . 0.404 ' HA ' ' CD ' ' T' ' 22' ' ' GLU . . . -57.95 -49.66 76.03 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.653 -0.419 . . . . 57.44 110.901 174.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 20' ' ' LEU . . . . . . . . . . . . . . . -59.03 -39.72 82.83 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 119.603 -0.839 . . . . 77.15 110.707 176.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 21' ' ' LEU . . . . . . . . . . . . . . . -52.12 -42.17 63.1 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.735 0.302 . . . . 91.02 110.458 173.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 22' ' ' GLU . . . . . 0.577 ' HG3' ' O ' ' T' ' 18' ' ' ILE . 39.0 mt-10 -57.97 -22.35 48.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.81 0.67 . . . . 94.31 112.81 -178.769 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' T' T ' 23' ' ' LYS . . . . . . . . . . . . . 29.5 ttpt -115.83 14.56 16.3 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 113.292 0.849 . . . . 78.36 113.292 -162.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 24' ' ' TRP . . . . . 0.621 ' HZ3' ' HG ' ' R' ' 1' ' ' SER . 0.3 OUTLIER -155.8 101.54 2.14 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 108.54 -0.911 . . . . 92.86 108.54 172.971 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' T' T ' 25' ' ' GLY . . . . . . . . . . . . . . . 147.98 39.51 0.04 OUTLIER Glycine 0 C--N 1.332 0.351 0 O-C-N 123.717 0.636 . . . . 109.18 114.087 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 O-C-N 122.862 -0.199 . . . . 106.59 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' U' U ' 1' ' ' SER . . . . . 0.417 ' O ' ' HB2' ' U' ' 5' ' ' GLU . 6.4 t . . . . . 0 C--O 1.232 0.175 0 CA-C-O 121.863 0.839 . . . . 46.4 109.747 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 2' ' ' LYS . . . . . 0.719 ' NZ ' ' O ' ' U' ' 101' ' ' HOH . 2.3 mppt? -87.68 22.23 2.33 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 115.298 -0.865 . . . . 47.34 113.061 -167.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 3' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' U' ' 102' ' ' HOH . 4.8 tp -122.61 -49.43 2.01 Favored 'General case' 0 CA--C 1.514 -0.416 0 O-C-N 121.962 -0.461 . . . . 34.16 111.768 166.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 4' ' ' LEU . . . . . . . . . . . . . 2.9 mt -60.81 -33.6 73.25 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 119.291 -0.964 . . . . 44.39 110.382 170.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 5' ' ' GLU . . . . . 0.417 ' HB2' ' O ' ' U' ' 1' ' ' SER . 0.5 OUTLIER -70.6 -33.84 71.49 Favored 'General case' 0 C--O 1.24 0.567 0 C-N-CA 118.79 -1.164 . . . . 46.11 110.878 175.531 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' U' U ' 6' ' ' LEU . . . . . 0.438 HD13 ' O ' ' W' ' 13' ' ' ALA . 3.9 tp -56.06 -49.49 73.61 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.613 0.721 . . . . 48.78 110.468 168.496 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 7' ' ' LEU . . . . . . . . . . . . . 20.2 tp -56.09 -39.97 72.94 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.353 -0.839 . . . . 42.68 110.415 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 8' ' ' ARG . . . . . . . . . . . . . 14.9 ttp85 -60.78 -55.38 33.85 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 116.134 -0.485 . . . . 47.53 110.942 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 9' ' ' LYS . . . . . 0.473 ' HD3' ' HG2' ' W' ' 9' ' ' LYS . 26.1 mttm -64.43 -31.14 72.23 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 117.996 -1.482 . . . . 57.63 111.187 -176.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 10' ' ' LEU . . . . . . . . . . . . . 44.7 tp -63.13 -52.1 63.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 118.723 -1.191 . . . . 39.7 111.393 171.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.32 -39.33 66.93 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-O 120.931 0.396 . . . . 37.62 110.889 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 12' ' ' GLU . . . . . 0.403 ' O ' ' N ' ' U' ' 15' ' ' HIS . 14.6 mt-10 -59.08 -61.01 2.96 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.207 -0.597 . . . . 62.32 109.725 175.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 13' ' ' ALA . . . . . . . . . . . . . . . -42.46 -42.53 3.31 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.212 0.529 . . . . 48.47 110.278 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 14' ' ' LEU . . . . . 0.467 HD23 ' O ' ' S' ' 101' ' ' HOH . 0.6 OUTLIER -63.0 -46.91 85.43 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.663 -0.699 . . . . 51.61 110.978 177.429 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' U' U ' 15' ' ' HIS . . . . . 0.403 ' N ' ' O ' ' U' ' 12' ' ' GLU . 1.7 t60 -51.38 -45.53 62.48 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-O 121.561 0.696 . . . . 75.22 111.199 176.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 16' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -81.06 -23.97 38.15 Favored 'General case' 0 C--N 1.321 -0.648 0 C-N-CA 119.539 -0.864 . . . . 64.41 112.462 -174.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' U' U ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.54 -45.82 92.55 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 120.23 -0.588 . . . . 46.65 110.475 167.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 18' ' ' ILE . . . . . . . . . . . . . 68.1 mt -51.45 -61.08 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.52 -0.2 0 N-CA-C 109.67 -0.493 . . . . 56.81 109.67 171.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 19' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -45.87 -39.05 8.06 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 120.996 0.427 . . . . 63.17 112.044 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 20' ' ' LEU . . . . . . . . . . . . . 30.3 mt -71.23 -36.63 71.89 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 119.79 -0.764 . . . . 52.05 111.127 179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 21' ' ' LEU . . . . . . . . . . . . . 4.8 tp -63.23 -41.09 99.07 Favored 'General case' 0 C--O 1.239 0.504 0 C-N-CA 119.931 -0.708 . . . . 65.18 110.796 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 22' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -56.39 -62.99 1.34 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 116.191 -0.459 . . . . 46.25 110.777 175.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 tttt -54.38 -61.1 2.53 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.22 -0.592 . . . . 68.35 111.047 -178.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 24' ' ' TRP . . . . . . . . . . . . . 43.8 m95 . . . . . 0 C--O 1.235 0.335 0 CA-C-O 121.41 0.624 . . . . 83.39 111.108 179.174 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 1' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 C--O 1.244 0.799 0 CA-C-O 121.38 0.61 . . . . 61.28 110.092 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 2' ' ' LYS . . . . . 0.446 ' HG2' ' N ' ' V' ' 3' ' ' LEU . 0.1 OUTLIER -50.55 -45.83 57.21 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 114.496 -1.229 . . . . 82.43 110.267 173.272 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' V' V ' 3' ' ' LEU . . . . . 0.446 ' N ' ' HG2' ' V' ' 2' ' ' LYS . 3.8 tp -68.3 -34.1 75.54 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.441 -0.345 . . . . 69.94 111.066 -179.67 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 mt -59.03 -52.23 66.65 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.137 -1.025 . . . . 81.9 110.476 176.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 5' ' ' GLU . . . . . . . . . . . . . . . -63.66 -38.6 91.72 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 119.56 -0.856 . . . . 57.03 111.259 179.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 6' ' ' LEU . . . . . 0.482 ' HA ' ' HD2' ' X' ' 16' ' ' LYS . 8.4 tp -54.22 -51.23 65.1 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-O 121.342 0.591 . . . . 59.17 110.397 176.33 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 7' ' ' LEU . . . . . 0.752 ' O ' HD12 ' V' ' 11' ' ' LEU . 0.6 OUTLIER -55.82 -41.27 73.98 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.873 -0.603 . . . . 67.32 110.666 176.83 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' V' V ' 8' ' ' ARG . . . . . . . . . . . . . . . -57.46 -58.87 6.38 Favored 'General case' 0 C--O 1.24 0.567 0 CA-C-O 121.679 0.752 . . . . 60.57 110.885 -178.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 9' ' ' LYS . . . . . 0.4 ' HB2' ' NZ ' ' X' ' 16' ' ' LYS . 10.9 mttt -69.73 -21.79 63.44 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.307 -1.357 . . . . 64.68 111.391 -177.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 10' ' ' LEU . . . . . . . . . . . . . 5.6 mt -59.02 -51.83 68.36 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-O 121.185 0.517 . . . . 51.75 110.819 168.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 11' ' ' LEU . . . . . 0.752 HD12 ' O ' ' V' ' 7' ' ' LEU . 0.9 OUTLIER -50.78 -42.65 58.07 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 116.141 -0.482 . . . . 66.41 110.778 172.616 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' V' V ' 12' ' ' GLU . . . . . 0.432 ' O ' ' HG3' ' V' ' 16' ' ' LYS . . . -57.84 -56.99 14.82 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 119.974 -0.69 . . . . 69.49 110.644 -179.11 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 13' ' ' ALA . . . . . 0.605 ' HA ' ' HD2' ' V' ' 16' ' ' LYS . . . -50.02 -40.14 43.76 Favored 'General case' 0 C--O 1.24 0.585 0 CA-C-O 121.041 0.448 . . . . 57.55 110.554 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 14' ' ' LEU . . . . . 0.406 ' O ' HG13 ' V' ' 18' ' ' ILE . 2.6 tm? -57.65 -57.76 11.31 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 121.295 0.569 . . . . 78.48 110.801 179.577 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 15' ' ' HIS . . . . . . . . . . . . . . . -54.26 -35.42 62.5 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 120.484 -0.486 . . . . 101.21 111.353 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 16' ' ' LYS . . . . . 0.605 ' HD2' ' HA ' ' V' ' 13' ' ' ALA . 7.8 mttt -64.6 -48.56 74.46 Favored 'General case' 0 C--O 1.241 0.623 0 C-N-CA 119.773 -0.771 . . . . 112.47 111.177 179.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 17' ' ' ALA . . . . . . . . . . . . . . . -54.66 -42.69 71.65 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 119.858 -0.737 . . . . 62.1 110.689 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 18' ' ' ILE . . . . . 0.406 HG13 ' O ' ' V' ' 14' ' ' LEU . 2.6 mt -62.03 -44.38 98.89 Favored 'Isoleucine or valine' 0 C--O 1.236 0.355 0 CA-C-O 121.243 0.544 . . . . 62.19 110.328 -179.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 19' ' ' GLU . . . . . . . . . . . . . . . -56.2 -47.25 78.72 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-O 120.954 0.407 . . . . 76.65 110.785 177.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 20' ' ' LEU . . . . . . . . . . . . . 9.6 mt -61.64 -46.06 91.4 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 119.809 -0.756 . . . . 78.24 110.715 -178.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' V' V ' 21' ' ' LEU . . . . . 0.612 HD22 HG21 ' T' ' 18' ' ' ILE . 2.9 tt -51.2 -52.66 42.31 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 121.315 0.579 . . . . 84.15 110.973 175.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 22' ' ' GLU . . . . . 0.495 ' HB3' ' HG2' ' T' ' 22' ' ' GLU . 16.1 mt-10 -67.03 -38.55 86.1 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 120.104 -0.638 . . . . 82.45 111.255 -173.3 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 23' ' ' LYS . . . . . 0.44 ' HG3' ' CD1' ' V' ' 24' ' ' TRP . 10.3 tptt -65.06 -38.56 91.2 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.322 -0.551 . . . . 97.14 110.996 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' V' V ' 24' ' ' TRP . . . . . 0.44 ' CD1' ' HG3' ' V' ' 23' ' ' LYS . 64.4 m95 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 120.255 -0.578 . . . . 69.62 110.832 175.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 1' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.232 0.162 0 CA-C-O 121.334 0.588 . . . . 56.48 110.871 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' W' W ' 2' ' ' LYS . . . . . . . . . . . . . 3.7 mtpp -68.69 -25.45 64.8 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.901 -0.59 . . . . 50.42 111.958 176.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 3' ' ' LEU . . . . . 0.808 HD21 ' HA ' ' X' ' 21' ' ' LEU . 13.8 tp -65.76 -43.08 89.96 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 120.576 -0.449 . . . . 55.7 111.578 170.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 4' ' ' LEU . . . . . 0.746 HD23 HD11 ' X' ' 21' ' ' LEU . 2.9 mt -66.1 -38.27 87.83 Favored 'General case' 0 C--O 1.234 0.244 0 O-C-N 121.949 -0.469 . . . . 56.12 111.165 177.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.04 -40.31 95.3 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 120.423 -0.511 . . . . 45.98 111.202 175.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 6' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.72 -52.37 65.42 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 120.389 -0.524 . . . . 41.29 111.195 174.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 7' ' ' LEU . . . . . . . . . . . . . 12.7 tp -54.22 -42.3 69.67 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.776 -0.769 . . . . 38.38 110.227 179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 8' ' ' ARG . . . . . . . . . . . . . 60.2 ttp85 -55.68 -62.06 1.94 Allowed 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.39 0.676 . . . . 50.46 111.464 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 9' ' ' LYS . . . . . 0.473 ' HG2' ' HD3' ' U' ' 9' ' ' LYS . 7.9 mttp -69.17 -24.13 64.02 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 118.243 -1.383 . . . . 74.01 112.021 -174.735 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 10' ' ' LEU . . . . . . . . . . . . . 6.4 tp -63.76 -48.16 78.08 Favored 'General case' 0 C--O 1.236 0.344 0 C-N-CA 119.738 -0.785 . . . . 44.77 110.369 173.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 11' ' ' LEU . . . . . . . . . . . . . 81.5 mt -62.7 -37.21 85.58 Favored 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 119.328 -0.949 . . . . 36.79 111.033 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 12' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -64.29 -43.57 94.34 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 118.784 -1.167 . . . . 55.65 110.362 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 13' ' ' ALA . . . . . 0.438 ' O ' HD13 ' U' ' 6' ' ' LEU . . . -54.23 -45.43 72.3 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-O 121.28 0.562 . . . . 42.66 110.356 173.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 14' ' ' LEU . . . . . 0.75 HD12 ' HB2' ' X' ' 10' ' ' LEU . 1.9 tt -65.09 -40.74 95.02 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.075 -0.65 . . . . 60.08 110.852 -178.159 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 15' ' ' HIS . . . . . . . . . . . . . 49.2 t-80 -54.81 -39.1 68.14 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 120.888 0.375 . . . . 36.46 111.177 175.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 16' ' ' LYS . . . . . . . . . . . . . 30.5 mmtt -84.39 -28.45 26.93 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 117.505 -1.678 . . . . 66.35 111.472 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 17' ' ' ALA . . . . . 0.694 ' O ' HD23 ' W' ' 21' ' ' LEU . . . -59.45 -40.5 87.04 Favored 'General case' 0 C--O 1.243 0.72 0 C-N-CA 119.611 -0.836 . . . . 48.8 110.419 168.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 18' ' ' ILE . . . . . 0.577 ' HA ' HD21 ' W' ' 21' ' ' LEU . 6.4 mt -60.59 -63.06 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.145 -0.479 . . . . 63.77 109.84 177.088 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' W' W ' 19' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -42.68 -34.68 0.94 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.903 0.382 . . . . 65.0 111.428 178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 20' ' ' LEU . . . . . . . . . . . . . 4.4 mt -66.91 -56.02 12.1 Favored 'General case' 0 C--O 1.24 0.574 0 C-N-CA 119.457 -0.897 . . . . 55.64 110.659 178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 21' ' ' LEU . . . . . 0.848 HD22 HD11 ' X' ' 7' ' ' LEU . 0.6 OUTLIER -70.81 -19.53 62.67 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 116.096 -2.242 . . . . 59.25 111.436 -173.778 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' W' W ' 22' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -69.57 -3.17 13.73 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.565 0.58 . . . . 56.96 112.565 -176.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 ttpt -130.03 -38.12 1.45 Allowed 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 118.061 -1.456 . . . . 56.38 112.697 156.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' W' W ' 24' ' ' TRP . . . . . . . . . . . . . 18.1 m95 . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.704 0.631 . . . . 60.32 112.704 -173.654 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 1' ' ' SER . . . . . . . . . . . . . 5.2 p . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.798 0.333 . . . . 67.44 111.212 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 2' ' ' LYS . . . . . . . . . . . . . . . -125.01 -39.71 2.22 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.204 -0.453 . . . . 58.92 111.155 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 3' ' ' LEU . . . . . 0.654 HD22 ' HB3' ' W' ' 21' ' ' LEU . 1.1 tt -60.64 -47.98 83.82 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.215 -0.448 . . . . 61.6 111.213 -179.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 4' ' ' LEU . . . . . 0.72 ' HA ' HD12 ' X' ' 7' ' ' LEU . 4.2 mp -58.5 -47.66 83.37 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 123.197 1.475 . . . . 80.8 109.528 -179.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 5' ' ' GLU . . . . . . . . . . . . . . . -54.87 -44.47 74.07 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 113.975 -1.466 . . . . 86.08 110.677 176.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 6' ' ' LEU . . . . . 0.531 ' CD2' HD11 ' X' ' 10' ' ' LEU . 4.3 tt -52.15 -47.28 65.51 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-O 121.704 0.764 . . . . 66.35 110.594 177.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 7' ' ' LEU . . . . . 0.848 HD11 HD22 ' W' ' 21' ' ' LEU . 3.4 mt -64.84 -48.86 72.83 Favored 'General case' 0 CA--C 1.514 -0.437 0 CA-C-N 115.682 -0.69 . . . . 74.65 110.898 -175.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 8' ' ' ARG . . . . . . . . . . . . . . . -59.79 -34.0 72.46 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.173 -1.011 . . . . 56.3 110.886 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 9' ' ' LYS . . . . . . . . . . . . . . . -60.54 -50.04 75.12 Favored 'General case' 0 C--O 1.239 0.532 0 C-N-CA 119.983 -0.687 . . . . 55.08 110.268 176.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 10' ' ' LEU . . . . . 0.75 ' HB2' HD12 ' W' ' 14' ' ' LEU . 24.5 mt -62.15 -31.37 71.84 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 118.698 -1.201 . . . . 62.32 111.099 178.003 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 11' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -72.3 -37.34 68.98 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 118.818 -1.153 . . . . 73.13 111.067 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 12' ' ' GLU . . . . . 0.488 ' O ' ' HE3' ' X' ' 16' ' ' LYS . 1.6 mt-10 -73.7 -41.14 63.02 Favored 'General case' 0 C--O 1.241 0.642 0 C-N-CA 118.837 -1.145 . . . . 100.26 110.553 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 13' ' ' ALA . . . . . . . . . . . . . . . -55.21 -37.24 66.87 Favored 'General case' 0 CA--C 1.518 -0.274 0 C-N-CA 120.166 -0.614 . . . . 67.36 110.441 170.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -68.65 -36.91 79.19 Favored 'General case' 0 CA--C 1.519 -0.233 0 C-N-CA 122.39 0.276 . . . . 61.91 110.963 177.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 15' ' ' HIS . . . . . 0.54 ' NE2' ' OE2' ' X' ' 19' ' ' GLU . 22.9 t-160 -58.16 -53.15 61.55 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-O 121.764 0.792 . . . . 73.52 110.333 175.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 16' ' ' LYS . . . . . 0.488 ' HE3' ' O ' ' X' ' 12' ' ' GLU . 2.6 mttt -59.35 -39.03 81.92 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.664 -0.698 . . . . 76.31 110.966 177.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.56 -46.12 91.24 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 120.947 0.403 . . . . 90.38 111.002 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 18' ' ' ILE . . . . . . . . . . . . . . . -61.54 -42.73 95.13 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-O 121.198 0.523 . . . . 74.99 109.783 179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 19' ' ' GLU . . . . . 0.54 ' OE2' ' NE2' ' X' ' 15' ' ' HIS . 23.7 mt-10 -63.87 -48.84 75.08 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 119.512 -0.875 . . . . 83.93 110.962 -176.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 20' ' ' LEU . . . . . 0.563 ' O ' ' HB2' ' X' ' 24' ' ' TRP . . . -68.92 -26.77 65.25 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 120.2 -0.6 . . . . 66.35 111.857 -178.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 21' ' ' LEU . . . . . 0.808 ' HA ' HD21 ' W' ' 3' ' ' LEU . 2.5 tt -75.21 -42.73 54.87 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 119.493 -0.883 . . . . 88.48 110.966 178.478 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' X' X ' 22' ' ' GLU . . . . . . . . . . . . . . . -62.04 -41.57 98.26 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.17 -0.612 . . . . 112.85 110.86 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 23' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.59 -61.61 1.95 Allowed 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.183 -0.607 . . . . 107.35 111.615 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' X' X ' 24' ' ' TRP . . . . . 0.563 ' HB2' ' O ' ' X' ' 20' ' ' LEU . 5.3 m95 . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.571 -0.529 . . . . 123.59 109.571 173.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 1' ' ' SER . . . . . 0.48 ' O ' ' OG ' ' Y' ' 1' ' ' SER . 1.5 t . . . . . 0 CA--C 1.514 -0.441 0 CA-C-O 120.841 0.353 . . . . 60.31 110.634 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 2' ' ' LYS . . . . . . . . . . . . . 26.4 mmtp -120.93 -49.11 2.22 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 115.75 -0.659 . . . . 73.13 112.423 -178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 3' ' ' LEU . . . . . 0.463 HD12 ' HB3' ' Y' ' 6' ' ' LEU . 17.9 tp -58.92 -27.83 65.65 Favored 'General case' 0 CA--C 1.52 -0.21 0 C-N-CA 118.919 -1.112 . . . . 58.47 110.767 169.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 4' ' ' LEU . . . . . 0.531 ' O ' ' HB3' ' Y' ' 7' ' ' LEU . 3.7 mp -48.54 -45.07 36.97 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.222 -0.591 . . . . 52.69 110.517 168.198 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 5' ' ' GLU . . . . . . . . . . . . . . . -74.91 -34.87 62.21 Favored 'General case' 0 C--O 1.24 0.577 0 C-N-CA 119.893 -0.723 . . . . 50.17 111.823 -178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 6' ' ' LEU . . . . . 0.463 ' HB3' HD12 ' Y' ' 3' ' ' LEU . 2.3 tp -50.99 -56.24 13.45 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.333 -0.947 . . . . 43.9 108.973 170.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 7' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' Y' ' 4' ' ' LEU . 53.2 tp -43.32 -61.18 1.42 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.931 1.292 . . . . 39.04 111.038 174.508 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 8' ' ' ARG . . . . . 0.518 ' O ' ' N ' ' Y' ' 11' ' ' LEU . . . -56.37 -66.75 0.38 Allowed 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.709 -0.678 . . . . 62.69 111.657 -173.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 9' ' ' LYS . . . . . 0.628 ' NZ ' ' OE2' ' A' ' 12' ' ' GLU . 38.7 mttt -54.36 -28.63 44.28 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 118.453 -1.299 . . . . 48.43 110.487 -175.624 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 10' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' Y' ' 7' ' ' LEU . 28.7 tp -62.01 -46.17 90.4 Favored 'General case' 0 N--CA 1.445 -0.688 0 C-N-CA 119.797 -0.761 . . . . 48.53 110.55 170.926 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 11' ' ' LEU . . . . . 0.518 ' N ' ' O ' ' Y' ' 8' ' ' ARG . 36.0 mt -60.89 -46.56 90.14 Favored 'General case' 0 CA--C 1.513 -0.481 0 CA-C-O 121.134 0.492 . . . . 38.72 110.428 -177.733 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 12' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -55.04 -43.82 74.11 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-N 116.17 -0.468 . . . . 52.39 110.291 173.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.17 99.54 Favored 'General case' 0 CA--C 1.512 -0.485 0 C-N-CA 120.183 -0.607 . . . . 60.2 110.306 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 14' ' ' LEU . . . . . . . . . . . . . 4.4 tp -57.05 -48.46 78.49 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-O 121.364 0.602 . . . . 58.7 109.843 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 15' ' ' HIS . . . . . 0.545 ' ND1' ' O ' ' Y' ' 101' ' ' HOH . 2.4 t60 -63.53 -29.43 70.69 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.059 -0.657 . . . . 61.79 110.673 -177.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 16' ' ' LYS . . . . . 0.562 ' HA ' ' HG2' ' Y' ' 19' ' ' GLU . 5.7 mttt -78.42 -31.6 48.26 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.252 -0.979 . . . . 74.43 111.843 179.165 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 17' ' ' ALA . . . . . 0.556 ' HB3' HD12 ' Z' ' 7' ' ' LEU . . . -58.58 -45.58 88.74 Favored 'General case' 0 C--O 1.24 0.582 0 C-N-CA 119.491 -0.884 . . . . 60.16 109.909 167.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 18' ' ' ILE . . . . . 0.628 ' HA ' HD12 ' Y' ' 21' ' ' LEU . 13.5 mt -55.76 -47.12 79.8 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.762 -0.653 . . . . 49.45 110.455 176.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 19' ' ' GLU . . . . . 0.562 ' HG2' ' HA ' ' Y' ' 16' ' ' LYS . 1.7 pt-20 -64.97 -37.45 87.69 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 120.097 -0.641 . . . . 91.43 111.097 -175.087 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 20' ' ' LEU . . . . . 0.539 HD12 ' HA ' ' Y' ' 17' ' ' ALA . 3.9 mt -62.58 -43.0 99.89 Favored 'General case' 0 CA--C 1.515 -0.391 0 C-N-CA 119.187 -1.005 . . . . 51.44 109.686 175.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 21' ' ' LEU . . . . . 0.628 HD12 ' HA ' ' Y' ' 18' ' ' ILE . 10.6 mt -55.93 -38.89 70.89 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 120.644 -0.422 . . . . 69.41 111.093 176.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Y' Y ' 22' ' ' GLU . . . . . . . . . . . . . 89.9 mt-10 -69.52 -55.23 10.78 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.358 -0.537 . . . . 60.26 110.956 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 23' ' ' LYS . . . . . . . . . . . . . 15.5 ttmt -55.28 -31.01 61.26 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.389 -0.524 . . . . 70.89 111.645 178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 24' ' ' TRP . . . . . . . . . . . . . 7.5 m95 . . . . . 0 C--N 1.327 -0.383 0 C-N-CA 120.422 -0.511 . . . . 88.58 111.1 172.62 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 1' ' ' SER . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.44 -0.578 . . . . 69.36 109.44 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 2' ' ' LYS . . . . . . . . . . . . . . . -52.45 -25.55 10.38 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 115.535 -0.757 . . . . 69.81 111.316 169.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 3' ' ' LEU . . . . . 0.526 ' O ' ' HB3' ' Z' ' 6' ' ' LEU . 1.2 tt -59.64 -51.09 71.31 Favored 'General case' 0 C--O 1.237 0.437 0 CA-C-O 121.133 0.492 . . . . 76.22 110.848 170.426 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 4' ' ' LEU . . . . . . . . . . . . . 2.6 tp -63.28 -39.13 93.72 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 119.386 -0.926 . . . . 76.96 110.682 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 5' ' ' GLU . . . . . . . . . . . . . . . -56.25 -46.67 79.53 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 119.866 -0.734 . . . . 65.74 110.281 173.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' O ' ' Z' ' 3' ' ' LEU . 5.9 tt -49.47 -56.26 10.38 Favored 'General case' 0 CA--C 1.513 -0.464 0 CA-C-O 121.323 0.582 . . . . 68.52 110.721 175.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 7' ' ' LEU . . . . . 0.556 HD12 ' HB3' ' Y' ' 17' ' ' ALA . 1.1 tt -68.04 -34.51 76.6 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.795 -0.639 . . . . 66.57 111.2 -171.958 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 8' ' ' ARG . . . . . . . . . . . . . . . -61.35 -47.93 83.61 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.149 -0.62 . . . . 65.56 110.588 174.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 9' ' ' LYS . . . . . 0.543 ' NZ ' ' O ' ' Z' ' 102' ' ' HOH . 63.3 mmtt -65.02 -37.0 86.18 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.061 -1.055 . . . . 65.8 110.405 -178.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 10' ' ' LEU . . . . . . . . . . . . . . . -63.01 -35.2 79.41 Favored 'General case' 0 C--O 1.233 0.19 0 C-N-CA 120.409 -0.517 . . . . 60.44 110.734 176.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 tt -67.37 -41.2 85.48 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 120.334 -0.546 . . . . 71.13 111.442 176.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 12' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -61.99 -46.51 88.92 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 119.146 -1.022 . . . . 89.7 109.989 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 13' ' ' ALA . . . . . . . . . . . . . . . -56.62 -33.71 66.53 Favored 'General case' 0 C--O 1.237 0.425 0 O-C-N 122.09 -0.381 . . . . 61.12 111.234 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 14' ' ' LEU . . . . . 0.563 HD13 HD13 ' Z' ' 18' ' ' ILE . 2.7 tm? -63.63 -60.93 2.69 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.202 0.525 . . . . 62.22 110.183 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 15' ' ' HIS . . . . . . . . . . . . . . . -47.02 -40.31 14.46 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 115.972 -0.558 . . . . 83.97 111.395 174.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 16' ' ' LYS . . . . . 1.093 ' O ' HD12 ' Z' ' 20' ' ' LEU . . . -54.13 -60.71 2.98 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-O 121.089 0.471 . . . . 74.85 110.326 175.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 17' ' ' ALA . . . . . 0.548 ' HA ' HD13 ' Z' ' 20' ' ' LEU . . . -49.53 -46.6 48.73 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-N 115.953 -0.567 . . . . 48.64 110.945 -179.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 18' ' ' ILE . . . . . 0.644 HG12 HD22 ' X' ' 21' ' ' LEU . 1.5 mp -61.34 -39.93 84.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 C-N-CA 119.745 -0.782 . . . . 60.75 109.899 -176.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 19' ' ' GLU . . . . . . . . . . . . . . . -62.01 -47.49 84.52 Favored 'General case' 0 C--O 1.241 0.637 0 C-N-CA 119.962 -0.695 . . . . 67.03 110.497 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 20' ' ' LEU . . . . . 1.093 HD12 ' O ' ' Z' ' 16' ' ' LYS . 4.0 mp -55.58 -38.97 70.07 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 119.865 -0.734 . . . . 72.74 110.091 178.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' Z' Z ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tt -62.24 -50.75 70.49 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 119.84 -0.744 . . . . 72.01 110.366 176.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 22' ' ' GLU . . . . . . . . . . . . . . . -51.36 -38.44 53.26 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.994 0.426 . . . . 80.07 110.764 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 23' ' ' LYS . . . . . . . . . . . . . . . -70.78 -60.73 2.08 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.64 -0.824 . . . . 77.72 111.112 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 24' ' ' TRP . . . . . . . . . . . . . . . -70.06 110.84 5.33 Favored 'General case' 0 C--O 1.235 0.328 0 O-C-N 122.097 -0.377 . . . . 70.92 110.781 -162.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 25' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.46 0 CA-C-N 116.076 -0.511 . . . . 72.41 112.258 172.18 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 1' ' ' SER . . . . . . . . . . . . . 30.9 t . . . . . 0 C--O 1.233 0.208 0 CA-C-O 121.222 0.534 . . . . 86.76 109.885 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 2' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -68.55 -44.3 74.79 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 115.516 -0.765 . . . . 75.13 111.254 -176.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 3' ' ' LEU . . . . . . . . . . . . . . . -62.38 -37.8 87.13 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.31 -0.956 . . . . 49.9 110.638 174.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 4' ' ' LEU . . . . . . . . . . . . . 17.9 mt -62.8 -48.28 79.78 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 119.993 -0.683 . . . . 47.38 110.717 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.23 -34.01 75.68 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 119.531 -0.868 . . . . 52.94 111.21 176.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 6' ' ' LEU . . . . . . . . . . . . . 7.6 tt -61.92 -40.08 94.23 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 119.479 -0.888 . . . . 51.2 110.705 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 7' ' ' LEU . . . . . . . . . . . . . 5.1 mt -63.03 -44.87 94.71 Favored 'General case' 0 CA--C 1.507 -0.688 0 C-N-CA 119.512 -0.875 . . . . 57.35 110.306 175.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 8' ' ' ARG . . . . . . . . . . . . . . . -49.06 -46.0 43.82 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-O 121.442 0.639 . . . . 48.46 110.296 176.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 9' ' ' LYS . . . . . . . . . . . . . . . -69.05 -47.2 65.96 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 119.515 -0.874 . . . . 62.17 111.28 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 10' ' ' LEU . . . . . . . . . . . . . 12.5 mt -50.62 -52.46 39.21 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 121.646 0.736 . . . . 46.43 110.129 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -57.14 -61.56 2.38 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.964 -0.562 . . . . 41.44 110.686 177.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 12' ' ' GLU . . . . . . . . . . . . . 25.3 mt-10 -46.93 -47.38 21.66 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.043 0.449 . . . . 81.86 110.995 -174.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 13' ' ' ALA . . . . . . . . . . . . . . . -52.79 -44.82 66.85 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.961 0.41 . . . . 39.91 111.169 170.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 14' ' ' LEU . . . . . . . . . . . . . 9.2 tp -65.63 -60.42 2.94 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 119.805 -0.758 . . . . 66.28 110.804 -175.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 15' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -39.1 -39.32 0.56 Allowed 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 125.456 1.502 . . . . 49.79 110.151 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 16' ' ' LYS . . . . . . . . . . . . . 7.9 mptt -70.11 -45.92 65.9 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.954 0.407 . . . . 67.52 111.094 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 17' ' ' ALA . . . . . . . . . . . . . . . -52.58 -39.68 61.81 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.576 -0.45 . . . . 59.08 110.568 173.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 18' ' ' ILE . . . . . . . . . . . . . 11.0 mt -55.55 -67.37 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.517 -0.29 0 N-CA-C 106.332 -1.729 . . . . 61.02 106.332 175.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 19' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -41.05 -50.98 3.39 Favored 'General case' 0 C--O 1.237 0.428 0 N-CA-C 112.961 0.726 . . . . 74.02 112.961 -176.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 20' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.11 -58.66 7.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.583 -0.847 . . . . 67.56 110.943 179.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 21' ' ' LEU . . . . . . . . . . . . . . . -58.81 -42.13 88.4 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 120.241 -0.584 . . . . 58.92 111.149 -173.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 22' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -53.24 -49.85 66.0 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.549 -0.296 . . . . 73.69 110.357 173.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 23' ' ' LYS . . . . . . . . . . . . . 2.5 mptt -63.57 -24.06 67.65 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 118.433 -1.307 . . . . 65.15 112.116 -179.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' a' a ' 24' ' ' TRP . . . . . . . . . . . . . 50.5 m95 . . . . . 0 C--N 1.325 -0.462 0 C-N-CA 120.409 -0.516 . . . . 93.58 111.255 -178.739 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.83 0.348 . . . . 71.54 110.5 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 3' ' ' LEU . . . . . . . . . . . . . 7.4 mp -62.24 -50.33 72.16 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 119.987 -0.685 . . . . 66.07 110.671 -177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 4' ' ' LEU . . . . . . . . . . . . . 3.5 mp -75.67 -27.32 58.26 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 119.425 -0.91 . . . . 65.12 112.011 -177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 5' ' ' GLU . . . . . . . . . . . . . . . -62.79 -45.23 93.63 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 119.23 -0.988 . . . . 82.39 109.956 171.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 6' ' ' LEU . . . . . . . . . . . . . 1.6 tt -50.92 -48.63 60.63 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.3 0.571 . . . . 80.45 110.622 171.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 7' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -57.22 -51.99 67.11 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 116.178 -0.465 . . . . 69.96 111.487 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 8' ' ' ARG . . . . . . . . . . . . . 31.8 ttt180 -49.16 -55.87 11.0 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.562 0.696 . . . . 94.87 110.547 179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 9' ' ' LYS . . . . . . . . . . . . . . . -62.74 -38.52 90.84 Favored 'General case' 0 C--O 1.238 0.457 0 CA-C-N 115.639 -0.71 . . . . 130.09 111.382 -176.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 10' ' ' LEU . . . . . . . . . . . . . 2.4 mt -63.63 -45.65 89.26 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.124 -1.03 . . . . 95.49 110.518 -178.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 11' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.05 -41.21 99.43 Favored 'General case' 0 C--O 1.241 0.611 0 C-N-CA 119.162 -1.015 . . . . 58.64 110.541 179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 12' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -55.26 -63.26 1.22 Allowed 'General case' 0 C--O 1.244 0.771 0 C-N-CA 120.51 -0.476 . . . . 79.5 109.957 177.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.17 15.82 Favored 'General case' 0 C--O 1.239 0.514 0 CA-C-N 116.236 -0.438 . . . . 75.25 111.715 177.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.01 -52.04 47.45 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 120.117 -0.633 . . . . 62.89 111.091 -176.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' b' b ' 15' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -60.19 -38.83 84.46 Favored 'General case' 0 C--O 1.242 0.692 0 C-N-CA 118.179 -1.408 . . . . 74.9 110.707 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 16' ' ' LYS . . . . . . . . . . . . . . . -51.29 -52.19 47.45 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.218 0.532 . . . . 93.23 110.796 175.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 17' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.25 94.16 Favored 'General case' 0 C--O 1.244 0.774 0 CA-C-N 116.136 -0.484 . . . . 86.53 111.669 -179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 18' ' ' ILE . . . . . . . . . . . . . 8.3 mt -63.23 -48.81 85.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 C-N-CA 119.019 -1.072 . . . . 71.3 110.08 -173.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 19' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -68.38 -25.34 65.02 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 117.672 -1.611 . . . . 99.58 111.543 178.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 20' ' ' LEU . . . . . . . . . . . . . 3.9 mt -63.48 -47.4 81.94 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 119.154 -1.019 . . . . 84.24 110.79 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 tt -72.58 -35.16 67.87 Favored 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 115.789 -2.364 . . . . 114.11 110.418 176.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 22' ' ' GLU . . . . . . . . . . . . . . . -43.09 -44.17 4.77 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 109.114 -0.698 . . . . 89.32 109.114 173.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 23' ' ' LYS . . . . . . . . . . . . . . . -61.75 -69.01 0.27 Allowed 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.716 -0.674 . . . . 77.06 110.378 165.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' b' b ' 24' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.47 0.527 0 O-C-N 121.746 -0.597 . . . . 79.74 111.835 -171.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 1' ' ' SER . . . . . . . . . . . . . 9.9 t . . . . . 0 C--O 1.218 -0.559 0 N-CA-C 111.464 0.172 . . . . 57.75 111.464 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 2' ' ' LYS . . . . . . . . . . . . . . . -59.83 -43.21 94.7 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.238 0.459 . . . . 57.7 112.238 -168.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 3' ' ' LEU . . . . . . . . . . . . . 11.6 tp -61.71 -45.29 94.61 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 118.958 -1.097 . . . . 54.85 110.66 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 4' ' ' LEU . . . . . . . . . . . . . 29.9 mt -57.18 -37.14 71.7 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 120.07 -0.652 . . . . 44.3 110.741 176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 5' ' ' GLU . . . . . . . . . . . . . . . -61.13 -48.54 81.16 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 121.238 0.542 . . . . 54.57 110.15 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 6' ' ' LEU . . . . . . . . . . . . . 3.0 tp -48.32 -58.76 4.13 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.695 0.759 . . . . 48.63 110.419 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 7' ' ' LEU . . . . . . . . . . . . . 6.9 tp -51.4 -63.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 115.101 -0.954 . . . . 39.61 110.213 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 8' ' ' ARG . . . . . . . . . . . . . 5.5 ptp180 -47.56 -45.84 27.4 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.707 -0.679 . . . . 75.28 111.221 -175.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 9' ' ' LYS . . . . . . . . . . . . . 25.4 mmtt -69.42 -32.45 71.44 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 117.995 -1.482 . . . . 54.92 110.224 -179.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 10' ' ' LEU . . . . . . . . . . . . . 1.6 tp -62.64 -42.43 99.59 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 119.319 -0.952 . . . . 53.35 111.081 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 11' ' ' LEU . . . . . . . . . . . . . 11.8 mt -68.79 -50.16 52.57 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-O 120.865 0.364 . . . . 38.65 111.102 -175.331 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 12' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -55.64 -36.5 67.09 Favored 'General case' 0 CA--C 1.519 -0.228 0 C-N-CA 119.029 -1.068 . . . . 48.53 110.178 174.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.23 -44.43 83.82 Favored 'General case' 0 C--O 1.239 0.526 0 C-N-CA 120.123 -0.631 . . . . 61.25 110.696 179.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 14' ' ' LEU . . . . . . . . . . . . . 1.9 mt -49.55 -54.5 17.72 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.219 0.533 . . . . 53.54 109.894 174.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -72.38 -25.29 61.45 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 119.441 -0.904 . . . . 72.75 111.653 -172.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 16' ' ' LYS . . . . . . . . . . . . . 7.1 tppt? -72.56 -38.83 67.84 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.159 -1.016 . . . . 50.87 110.585 176.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 17' ' ' ALA . . . . . . . . . . . . . . . -60.32 -41.51 93.65 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 120.551 -0.46 . . . . 62.79 110.77 170.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 18' ' ' ILE . . . . . . . . . . . . . 66.5 mt -58.96 -53.3 49.75 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 CA-C-O 121.406 0.622 . . . . 62.5 110.187 177.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 19' ' ' GLU . . . . . . . . . . . . . . . -57.72 -34.23 69.26 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-N 116.381 -0.372 . . . . 53.01 111.635 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 20' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.32 -45.3 63.35 Favored 'General case' 0 C--O 1.235 0.314 0 C-N-CA 119.209 -0.996 . . . . 48.88 111.225 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 21' ' ' LEU . . . . . . . . . . . . . 47.3 tp -63.04 -31.02 72.06 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.232 -0.987 . . . . 68.36 110.944 -179.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 22' ' ' GLU . . . . . . . . . . . . . . . -52.14 -22.18 4.0 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 120.151 -0.619 . . . . 56.48 111.804 174.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' c' c ' 23' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.275 0 CA-C-O 121.152 0.501 . . . . 61.76 110.898 172.434 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' d' d ' 1' ' ' SER . . . . . . . . . . . . . 37.1 t . . . . . 0 CA--C 1.518 -0.276 0 CA-C-O 122.153 0.978 . . . . 68.19 109.08 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' d' d ' 2' ' ' LYS . . . . . . . . . . . . . 3.3 mttt -56.02 -64.38 0.88 Allowed 'General case' 0 C--O 1.238 0.497 0 CA-C-N 113.815 -1.538 . . . . 67.5 110.822 177.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 3' ' ' LEU . . . . . . . . . . . . . 3.9 tp -63.05 -30.63 71.75 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.497 -0.481 . . . . 71.39 111.609 178.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 mp -57.17 -52.0 67.05 Favored 'General case' 0 C--O 1.242 0.673 0 CA-C-O 121.234 0.54 . . . . 74.6 110.764 177.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 5' ' ' GLU . . . . . . . . . . . . . . . -67.02 -37.3 83.91 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 116.321 -0.4 . . . . 71.13 111.104 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 6' ' ' LEU . . . . . . . . . . . . . 5.5 tt -54.96 -50.49 68.79 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 119.98 -0.688 . . . . 86.85 110.799 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.61 -40.52 88.86 Favored 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 120.62 -0.432 . . . . 91.74 110.91 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 8' ' ' ARG . . . . . . . . . . . . . . . -56.32 -51.69 67.29 Favored 'General case' 0 C--O 1.242 0.699 0 C-N-CA 119.33 -0.948 . . . . 105.39 110.596 176.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 mmtp -63.06 -45.44 92.18 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 119.736 -0.786 . . . . 83.59 110.853 -178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 10' ' ' LEU . . . . . . . . . . . . . 1.2 tt -59.57 -38.32 80.82 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 121.117 0.484 . . . . 65.38 110.763 -179.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 11' ' ' LEU . . . . . . . . . . . . . . . -63.39 -48.82 76.29 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 120.664 -0.414 . . . . 76.25 110.477 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 12' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -67.61 -31.23 71.11 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 116.998 -1.881 . . . . 102.71 111.418 -178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.02 -50.24 74.16 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.813 -0.755 . . . . 65.38 110.577 175.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 14' ' ' LEU . . . . . . . . . . . . . . . -55.75 -38.62 70.07 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 120.731 -0.388 . . . . 85.8 111.272 174.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 15' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -58.45 -53.51 57.56 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.31 -0.556 . . . . 124.71 110.691 -178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 16' ' ' LYS . . . . . . . . . . . . . 15.0 mttt -69.77 -26.97 64.55 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 118.421 -1.311 . . . . 77.05 111.236 -177.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 17' ' ' ALA . . . . . . . . . . . . . . . -61.8 -51.98 66.04 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.549 -0.861 . . . . 51.41 110.929 173.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 18' ' ' ILE . . . . . . . . . . . . . 3.2 mp -59.87 -29.1 42.43 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.323 0 C-N-CA 120.552 -0.459 . . . . 75.25 109.985 176.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 19' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.69 -52.04 67.19 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 119.61 -0.836 . . . . 86.59 110.482 174.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' d' d ' 20' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.59 -39.86 89.64 Favored 'General case' 0 C--O 1.192 -1.95 0 C-N-CA 118.302 -1.359 . . . . 58.66 111.221 177.633 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' d' d ' 21' ' ' LEU . . . . . . . . . . . . . 5.8 tt -60.86 -66.1 0.59 Allowed 'General case' 0 C--N 1.315 -0.925 0 C-N-CA 117.374 -1.73 . . . . 76.93 107.952 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 22' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -41.74 -38.67 1.51 Allowed 'General case' 0 C--O 1.235 0.328 0 C-N-CA 123.741 0.817 . . . . 101.54 110.656 -179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 23' ' ' LYS . . . . . . . . . . . . . . . -58.67 -58.64 7.67 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.592 -0.443 . . . . 93.6 111.057 173.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 24' ' ' TRP . . . . . . . . . . . . . 1.5 p-90 -70.33 -9.16 55.35 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.801 -0.76 . . . . 126.53 112.914 -175.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 25' ' ' GLY . . . . . . . . . . . . . . . 131.19 78.39 0.17 Allowed Glycine 0 N--CA 1.45 -0.423 0 CA-C-N 118.48 0.582 . . . . 104.03 112.847 -176.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' d' d ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.301 0 O-C-N 122.952 -0.146 . . . . 55.45 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 1' ' ' SER . . . . . . . . . . . . . 1.2 t . . . . . 0 CA--C 1.521 -0.147 0 CA-C-O 120.712 0.291 . . . . 56.81 111.51 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 2' ' ' LYS . . . . . . . . . . . . . . . -57.74 -34.91 70.02 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.605 -0.838 . . . . 64.06 110.802 178.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 3' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.89 -43.31 93.32 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 120.926 -0.31 . . . . 79.27 111.588 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' e' e ' 4' ' ' LEU . . . . . . . . . . . . . 8.6 mt -73.98 -39.81 63.42 Favored 'General case' 0 CA--C 1.517 -0.312 0 C-N-CA 119.894 -0.723 . . . . 58.91 111.554 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 5' ' ' GLU . . . . . . . . . . . . . . . -59.02 -45.75 89.92 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.602 -0.839 . . . . 56.48 109.984 175.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 6' ' ' LEU . . . . . . . . . . . . . 24.5 tp -61.75 -42.6 99.19 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 120.592 -0.443 . . . . 63.27 110.928 177.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 7' ' ' LEU . . . . . . . . . . . . . 5.3 tp -61.05 -55.12 36.43 Favored 'General case' 0 CA--C 1.514 -0.412 0 C-N-CA 119.985 -0.686 . . . . 55.76 109.923 179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -39.67 -46.44 1.84 Allowed 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 123.993 0.917 . . . . 51.56 110.871 171.625 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' e' e ' 9' ' ' LYS . . . . . . . . . . . . . . . -70.85 -46.73 62.17 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 119.736 -0.785 . . . . 76.44 111.423 -175.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 10' ' ' LEU . . . . . . . . . . . . . . . -56.01 -43.5 77.77 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 119.445 -0.902 . . . . 71.51 109.657 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 11' ' ' LEU . . . . . . . . . . . . . 2.4 mt -61.31 -41.14 96.51 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 120.861 -0.335 . . . . 60.07 111.288 177.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 12' ' ' GLU . . . . . . . . . . . . . . . -69.01 -48.95 61.75 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.447 -0.901 . . . . 62.77 110.948 -173.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.62 -28.74 70.12 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 118.252 -1.379 . . . . 54.02 110.427 175.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.03 -53.63 56.22 Favored 'General case' 0 CA--C 1.515 -0.385 0 C-N-CA 120.147 -0.621 . . . . 62.19 110.962 171.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' e' e ' 15' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -37.03 67.03 Favored 'General case' 0 CA--C 1.503 -0.86 0 C-N-CA 120.376 -0.53 . . . . 70.59 110.229 179.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' e' e ' 16' ' ' LYS . . . . . . . . . . . . . 1.5 tppt? -79.92 -27.41 39.89 Favored 'General case' 0 CA--C 1.505 -0.756 0 C-N-CA 113.883 -3.127 . . . . 65.59 110.942 -176.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 17' ' ' ALA . . . . . . . . . . . . . . . -53.66 -48.85 69.03 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.559 0.695 . . . . 69.06 109.498 168.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 18' ' ' ILE . . . . . . . . . . . . . 10.2 mt -58.78 -66.21 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.772 -0.649 . . . . 63.72 109.414 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 19' ' ' GLU . . . . . . . . . . . . . . . -55.16 -35.6 64.94 Favored 'General case' 0 CA--C 1.515 -0.399 0 C-N-CA 120.649 -0.42 . . . . 51.07 110.922 -172.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 20' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.38 -33.46 75.25 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 119.946 -0.702 . . . . 73.78 110.834 175.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 tp -65.92 -56.99 8.94 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 118.902 -1.119 . . . . 78.81 110.25 175.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 22' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -53.92 -21.34 7.67 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.343 0.497 . . . . 64.17 112.343 178.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 23' ' ' LYS . . . . . . . . . . . . . 39.9 mttp -81.72 -65.9 0.95 Allowed 'General case' 0 C--O 1.234 0.259 0 C-N-CA 119.665 -0.814 . . . . 56.79 110.494 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' e' e ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.235 0.318 0 C-N-CA 123.819 0.848 . . . . 68.03 112.613 -171.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 2' ' ' LYS . . . . . . . . . . . . . 40.2 mmtt . . . . . 0 C--O 1.236 0.386 0 N-CA-C 109.091 -0.707 . . . . 95.26 109.091 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' f' f ' 3' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.8 -32.88 60.79 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-N 115.503 -0.771 . . . . 91.5 110.631 169.819 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' f' f ' 4' ' ' LEU . . . . . . . . . . . . . 8.4 tt -58.95 -65.38 0.67 Allowed 'General case' 0 C--O 1.239 0.515 0 C-N-CA 123.168 0.587 . . . . 109.15 111.255 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 5' ' ' GLU . . . . . . . . . . . . . . . -57.94 -28.66 64.5 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 120.14 -0.624 . . . . 92.66 111.287 -179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 6' ' ' LEU . . . . . . . . . . . . . 1.3 mt -59.6 -54.99 40.14 Favored 'General case' 0 C--O 1.24 0.561 0 C-N-CA 119.864 -0.734 . . . . 78.61 110.623 174.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 7' ' ' LEU . . . . . . . . . . . . . . . -51.42 -41.2 60.62 Favored 'General case' 0 CA--C 1.515 -0.392 0 C-N-CA 120.18 -0.608 . . . . 81.16 110.309 175.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 8' ' ' ARG . . . . . . . . . . . . . . . -60.1 -54.57 44.34 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.345 0.593 . . . . 80.89 110.736 -177.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 9' ' ' LYS . . . . . . . . . . . . . . . -55.99 -37.22 68.8 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.317 -0.553 . . . . 88.05 110.581 179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 10' ' ' LEU . . . . . . . . . . . . . . . -59.36 -44.78 92.66 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 119.3 -0.96 . . . . 89.6 110.513 176.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 mt -61.88 -39.66 92.72 Favored 'General case' 0 CA--C 1.515 -0.38 0 C-N-CA 119.781 -0.767 . . . . 78.24 110.511 179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 12' ' ' GLU . . . . . . . . . . . . . . . -58.93 -55.34 36.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 120.107 -0.637 . . . . 74.0 110.003 179.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 13' ' ' ALA . . . . . . . . . . . . . . . -54.99 -35.73 64.66 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 115.7 -0.682 . . . . 85.79 111.052 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 14' ' ' LEU . . . . . . . . . . . . . 3.3 tp -67.6 -39.6 84.77 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 119.845 -0.742 . . . . 75.86 110.751 178.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 15' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -57.83 -44.64 86.57 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 119.006 -1.078 . . . . 77.76 110.056 174.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 16' ' ' LYS . . . . . . . . . . . . . 17.1 mmtm -58.67 -38.89 79.15 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.601 -0.44 . . . . 79.88 111.216 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 17' ' ' ALA . . . . . . . . . . . . . . . -64.99 -48.5 73.76 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.318 -0.553 . . . . 75.13 111.214 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 18' ' ' ILE . . . . . . . . . . . . . 2.7 pt -64.38 -31.07 52.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.49 0 C-N-CA 118.717 -1.193 . . . . 80.58 109.831 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 19' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -63.89 -44.11 94.0 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.957 0.408 . . . . 87.43 110.688 175.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 20' ' ' LEU . . . . . . . . . . . . . 11.0 mt -62.65 -31.8 72.73 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 119.236 -0.986 . . . . 93.23 110.901 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tt -75.1 -40.55 59.85 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.388 -0.525 . . . . 113.58 111.78 -174.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 22' ' ' GLU . . . . . . . . . . . . . . . -76.2 16.59 0.43 Allowed 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.686 0.625 . . . . 85.61 112.686 -168.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 23' ' ' LYS . . . . . . . . . . . . . 11.7 mttp -78.52 -34.65 47.12 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 112.77 0.656 . . . . 89.81 112.77 -173.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' f' f ' 24' ' ' TRP . . . . . . . . . . . . . 15.3 m95 . . . . . 0 C--N 1.326 -0.452 0 O-C-N 121.997 -0.44 . . . . 125.96 111.131 -174.65 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MPD . . . . . 0.543 ' H31' ' HE1' ' E' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 101' ' ' PO4 . . . . . 0.463 ' O3 ' ' NH2' ' E' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' I' I ' 101' ' ' PO4 . . . . . 0.443 ' O4 ' ' NH1' ' I' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 101' ' ' PO4 . . . . . 0.408 ' O3 ' ' OE1' ' M' ' 12' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Q' Q ' 101' ' ' CO3 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' HOH . . . . . 0.439 ' O ' ' HG3' ' B' ' 19' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' HOH . . . . . 0.635 ' O ' HD23 ' A' ' 14' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' F' F ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 101' ' ' HOH . . . . . 0.459 ' O ' ' O ' ' G' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' G' G ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' G' G ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 101' ' ' HOH . . . . . 0.412 ' O ' HD23 ' H' ' 21' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' H' H ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' H' H ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' J' J ' 101' ' ' HOH . . . . . 0.434 ' O ' ' NE1' ' J' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' K' K ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' K' K ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' K' K ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' K' K ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' K' K ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' K' K ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 101' ' ' HOH . . . . . 0.714 ' O ' ' NZ ' ' L' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' L' L ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' L' L ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' M' M ' 201' ' ' HOH . . . . . 0.68 ' O ' ' NH1' ' M' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 202' ' ' HOH . . . . . 0.645 ' O ' ' N ' ' M' ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 203' ' ' HOH . . . . . 0.421 ' O ' ' N ' ' M' ' 1' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' M' M ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' M' M ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' M' M ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' M' M ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' O' O ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Q' Q ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' R' R ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' R' R ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' R' R ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' S' S ' 101' ' ' HOH . . . . . 0.494 ' O ' ' NH2' ' S' ' 8' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' S' S ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' S' S ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' S' S ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' T' T ' 101' ' ' HOH . . . . . 0.434 ' O ' ' O ' ' T' ' 24' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' T' T ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' U' U ' 101' ' ' HOH . . . . . 0.719 ' O ' ' NZ ' ' U' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 102' ' ' HOH . . . . . 0.48 ' O ' ' N ' ' U' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' U' U ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' V' V ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' W' W ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' W' W ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' W' W ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' X' X ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Y' Y ' 101' ' ' HOH . . . . . 0.545 ' O ' ' ND1' ' Y' ' 15' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Y' Y ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Y' Y ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Y' Y ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Y' Y ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 102' ' ' HOH . . . . . 0.543 ' O ' ' NZ ' ' Z' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' Z' Z ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' Z' Z ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' a' a ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' b' b ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' c' c ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' d' d ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' e' e ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' f' f ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' f' f ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' f' f ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_